N-[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-4-[[[3-[[[5-hydroxy-8-[[2-(methylsulfonyl)-4-nitrophenyl]azo]-1-naphthalenyl]amino]sulfonyl]phenyl]sulfonyl]amino]-2-naphthalenecarboxamide (CAS 42905-20-4) — formula C54H58N6O12S3, molecular weight 1079.3; category organic chemicals.
| CAS Number | 42905-20-4 |
|---|---|
| Molecular Formula | C54H58N6O12S3 |
| Molecular Weight | 1079.3 |
| LogP | 12.2 |
| Applications | General Manufacturing Information: 2-Naphthalenecarboxamide, N-[4-[2, 4-bis(1, 1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-4-[[[3-[[[5-hydroxy-8-[2-[2-(methylsulfonyl)-4-nitrophenyl]diazenyl]-1-naphthalenyl]amino]sulfonyl]phenyl]sulfonyl]amino]-: INACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: 2-Naphthalenecarboxamide, N-[4-[2, 4-bis(1, 1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-4-[[[3-[[[5-hydroxy-8-[2-[2-(methylsulfonyl)-4-nitrophenyl]diazenyl]-1-naphthalenyl]amino]sulfonyl]phenyl]sulfonyl]amino]-: INACTIVE.
N-[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-4-[[[3-[[[5-hydroxy-8-[[2-(methylsulfonyl)-4-nitrophenyl]azo]-1-naphthalenyl]amino]sulfonyl]phenyl]sulfonyl]amino]-2-naphthalenecarboxamide is a carbon-based organic compound with CAS registry number 42905-20-4 and molecular formula C54H58N6O12S3 (molecular weight 1079.3), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 42905-20-4
Its molecular formula C54H58N6O12S3 comprises 54 C, 58 H, 6 N, 12 O, 3 S atoms.
Also known as: N-[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-4-[[[3-[[[5-hydroxy-8-[[2-(methylsulfonyl)-4-nitrophenyl]azo]-1-naphthalenyl]amino]sulfonyl]phenyl]sulfonyl]amino]-2-naphthalenecarboxamide · N-[4-[2,4-双(1,1-二甲基丙基)苯氧基]丁基]-1-羟基-4-[[[3-[[[5-羟基-8-[[2-(甲基磺酰基)-4-硝基苯基]偶氮]-1-萘基]氨基]磺酰基]苯基]磺酰基]氨基]-2-萘甲酰胺
Category: organic chemicals
The CAS registry number of N-[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-4-[[[3-[[[5-hydroxy-8-[[2-(methylsulfonyl)-4-nitrophenyl]azo]-1-naphthalenyl]amino]sulfonyl]phenyl]sulfonyl]amino]-2-naphthalenecarboxamide is 42905-20-4.
Molecular formula C54H58N6O12S3, molecular weight 1079.3.
It is also registered under: N-[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-4-[[[3-[[[5-hydroxy-8-[[2-(methylsulfonyl)-4-nitrophenyl]azo]-1-naphthalenyl]amino]sulfonyl]phenyl]sulfonyl]amino]-2-naphthalenecarboxamide, N-[4-[2,4-双(1,1-二甲基丙基)苯氧基]丁基]-1-羟基-4-[[[3-[[[5-羟基-8-[[2-(甲基磺酰基)-4-硝基苯基]偶氮]-1-萘基]氨基]磺酰基]苯基]磺酰基]氨基]-2-萘甲酰胺.
Recorded applications: General Manufacturing Information: 2-Naphthalenecarboxamide, N-[4-[2, 4-bis(1, 1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-4-[[[3-[[[5-hydroxy-8-[2-[2-(methylsulfonyl)-4-nitrophenyl]diazenyl]-1-naphthalenyl]amino]sulfonyl]phenyl]sulfonyl]amino]-: INACTIVE.
Category: Organic Chemicals.
Independent reference data for N-[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-4-[[[3-[[[5-hydroxy-8-[[2-(methylsulfonyl)-4-nitrophenyl]azo]-1-naphthalenyl]amino]sulfonyl]phenyl]sulfonyl]amino]-2-naphthalenecarboxamide (CAS 42905-20-4), compiled from public chemistry databases.
| CAS 号 | 42905-20-4 |
|---|---|
| PubChem CID | 135571038 |
| 分子式 | C54H58N6O12S3 |
| IUPAC 名称 | N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-hydroxy-4-[[3-[[5-hydroxy-8-[(2-methylsulfonyl-4-nitrophenyl)diazenyl]naphthalen-1-yl]sulfamoyl]phenyl]sulfonylamino]naphthalene-2-carboxamide |
| Molecular Weight | 1079.3 |
|---|---|
| XLogP3 | 12.2 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 16 |
| Rotatable Bond Count | 20 |
| Exact Mass | 1078.32748483 |
| Monoisotopic Mass | 1078.32748483 |
| Topological Polar Surface Area | 301 |
| Heavy Atom Count | 75 |
42905-20-4; RefChem:361608; DTXSID1068431; GZQJDLAHWMRYIG-UHFFFAOYSA-N
N-[4-[2,4-双(1,1-二甲基丙基)苯氧基]丁基]-1-羟基-4-[[[3-[[[5-羟基-8-[[2-(甲基磺酰基)-4-硝基苯基]偶氮]-1-萘基]氨基]磺酰基]苯基]磺酰基]氨基]-2-萘甲酰胺 · CAS 42905-20-4 · C54H58N6O12S3.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.