[5-(3,4-DIMETHOXY-PHENYL)-4-PHENYL-4 H-[1,2,4]TRIAZOL-3-YLSULFANYL]-ACETIC ACID (CAS 91759-73-8) — formula C18H17N3O4S, molecular weight 371.4; category organic chemicals.
| CAS Number | 91759-73-8 |
|---|---|
| Molecular Formula | C18H17N3O4S |
| Molecular Weight | 371.4 |
| LogP | 3.1 |
| Category | Organic Chemicals |
[5-(3,4-DIMETHOXY-PHENYL)-4-PHENYL-4 H-[1,2,4]TRIAZOL-3-YLSULFANYL]-ACETIC ACID is a carbon-based organic compound with CAS registry number 91759-73-8 and molecular formula C18H17N3O4S (molecular weight 371.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 91759-73-8
Its molecular formula C18H17N3O4S comprises 18 C, 17 H, 3 N, 4 O, 1 S atoms.
Also known as: [5-(3,4-DIMETHOXY-PHENYL)-4-PHENYL-4 H-[1,2,4]TRIAZOL-3-YLSULFANYL]-ACETIC ACID · [5-(3,4-二甲氧基-苯基)-4-苯基-4 H-[1,2,4]三唑-3-磺基]-乙酸
Category: organic chemicals
The CAS registry number of [5-(3,4-DIMETHOXY-PHENYL)-4-PHENYL-4 H-[1,2,4]TRIAZOL-3-YLSULFANYL]-ACETIC ACID is 91759-73-8.
Molecular formula C18H17N3O4S, molecular weight 371.4.
It is also registered under: [5-(3,4-DIMETHOXY-PHENYL)-4-PHENYL-4 H-[1,2,4]TRIAZOL-3-YLSULFANYL]-ACETIC ACID, [5-(3,4-二甲氧基-苯基)-4-苯基-4 H-[1,2,4]三唑-3-磺基]-乙酸.
Category: Organic Chemicals.
Independent reference data for [5-(3,4-DIMETHOXY-PHENYL)-4-PHENYL-4 H-[1,2,4]TRIAZOL-3-YLSULFANYL]-ACETIC ACID (CAS 91759-73-8), compiled from public chemistry databases.
| CAS 号 | 91759-73-8 |
|---|---|
| PubChem CID | 984201 |
| 分子式 | C18H17N3O4S |
| IUPAC 名称 | 2-[[5-(3,4-dimethoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid |
| UNII（FDA） | ST50411880 |
| Molecular Weight | 371.4 |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 7 |
| Exact Mass | 371.09397721 |
| Monoisotopic Mass | 371.09397721 |
| Topological Polar Surface Area | 112 |
| Heavy Atom Count | 26 |
91759-73-8; 2-((5-(3,4-Dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)acetic acid; {[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid; 2-[5-(3,4-dimethoxyphenyl)-4-phenyl-1,2,4-triazol-3-ylthio]acetic acid; CBKinase1_000930; CBKinase1_013330; Cambridge id 5736008; AG-690/12509134; CHEMBL290317; SCHEMBL6406347; SBB004468; AKOS005206970; 2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid; ST50411880; AB00095254-01; SR-01000218477
[5-(3,4-二甲氧基-苯基)-4-苯基-4 H-[1,2,4]三唑-3-磺基]-乙酸 · CAS 91759-73-8 · C18H17N3O4S. UNII ST50411880.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.