2-(2,4-Bis(1,1-dimethylpropyl)phenoxy)-N-(4-(4,5-dihydro-5-oxo-4-((1-phenyl-1H-tetrazol-5-yl)thio)-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl)phenyl)butanamide (CAS 30818-18-9) — formula C40H50N8O3S, molecular weight 722.9; category organic chemicals.
| CAS Number | 30818-18-9 |
|---|---|
| Molecular Formula | C40H50N8O3S |
| Molecular Weight | 722.9 |
| LogP | 9.6 |
| Applications | General Manufacturing Information: Butanamide, 2-[2, 4-bis(1, 1-dimethylpropyl)phenoxy]-N-[4-[4, 5-dihydro-5-oxo-4-[(1-phenyl-1H-tetrazol-5-yl)thio]-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl]phenyl]-: ACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: Butanamide, 2-[2, 4-bis(1, 1-dimethylpropyl)phenoxy]-N-[4-[4, 5-dihydro-5-oxo-4-[(1-phenyl-1H-tetrazol-5-yl)thio]-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl]phenyl]-: ACTIVE.
2-(2,4-Bis(1,1-dimethylpropyl)phenoxy)-N-(4-(4,5-dihydro-5-oxo-4-((1-phenyl-1H-tetrazol-5-yl)thio)-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl)phenyl)butanamide is a carbon-based organic compound with CAS registry number 30818-18-9 and molecular formula C40H50N8O3S (molecular weight 722.9), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 30818-18-9
Its molecular formula C40H50N8O3S comprises 40 C, 50 H, 8 N, 3 O, 1 S atoms.
Also known as: 2-(2,4-Bis(1,1-dimethylpropyl)phenoxy)-N-(4-(4,5-dihydro-5-oxo-4-((1-phenyl-1H-tetrazol-5-yl)thio)-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl)phenyl)butanamide · 2-[2,4-双(1,1-二甲基丙基)苯氧基]-N-[4-[4,5-二氢-5-氧代-4-[(1-苯基-1H-四唑-5-基)硫]-3-吡咯烷基]-1H-吡咯-1-基]苯基丁酰胺
Category: organic chemicals
The CAS registry number of 2-(2,4-Bis(1,1-dimethylpropyl)phenoxy)-N-(4-(4,5-dihydro-5-oxo-4-((1-phenyl-1H-tetrazol-5-yl)thio)-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl)phenyl)butanamide is 30818-18-9.
Molecular formula C40H50N8O3S, molecular weight 722.9.
It is also registered under: 2-(2,4-Bis(1,1-dimethylpropyl)phenoxy)-N-(4-(4,5-dihydro-5-oxo-4-((1-phenyl-1H-tetrazol-5-yl)thio)-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl)phenyl)butanamide, 2-[2,4-双(1,1-二甲基丙基)苯氧基]-N-[4-[4,5-二氢-5-氧代-4-[(1-苯基-1H-四唑-5-基)硫]-3-吡咯烷基]-1H-吡咯-1-基]苯基丁酰胺.
Recorded applications: General Manufacturing Information: Butanamide, 2-[2, 4-bis(1, 1-dimethylpropyl)phenoxy]-N-[4-[4, 5-dihydro-5-oxo-4-[(1-phenyl-1H-tetrazol-5-yl)thio]-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl]phenyl]-: ACTIVE.
Category: Organic Chemicals.
Independent reference data for 2-(2,4-Bis(1,1-dimethylpropyl)phenoxy)-N-(4-(4,5-dihydro-5-oxo-4-((1-phenyl-1H-tetrazol-5-yl)thio)-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl)phenyl)butanamide (CAS 30818-18-9), compiled from public chemistry databases.
| CAS 号 | 30818-18-9 |
|---|---|
| PubChem CID | 162991 |
| 分子式 | C40H50N8O3S |
| IUPAC 名称 | 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[4-[5-oxo-4-(1-phenyltetrazol-5-yl)sulfanyl-3-pyrrolidin-1-yl-4H-pyrazol-1-yl]phenyl]butanamide |
| UNII（FDA） | NS00126550 |
| Molecular Weight | 722.9 |
|---|---|
| XLogP3 | 9.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 14 |
| Exact Mass | 722.37265866 |
| Monoisotopic Mass | 722.37265866 |
| Topological Polar Surface Area | 143 |
| Heavy Atom Count | 52 |
30818-18-9; EINECS 250-348-4; DTXSID20866963; RefChem:570632; DTXCID70815188; SCHEMBL7167858; XBRACQJIEMMORN-UHFFFAOYSA-N; AKOS015895748; NS00126550
2-[2,4-双(1,1-二甲基丙基)苯氧基]-N-[4-[4,5-二氢-5-氧代-4-[(1-苯基-1H-四唑-5-基)硫]-3-吡咯烷基]-1H-吡咯-1-基]苯基丁酰胺 · CAS 30818-18-9 · C40H50N8O3S. UNII NS00126550.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2-[2,4-双(1,1-二甲基丙基)苯氧基]-N-[4-[4,5-二氢-5-氧代-4-[(1-苯基-1H-四唑-5-基)硫]-3-吡咯烷基]-1H-吡咯-1-基]苯基丁酰胺