benzhydryl 2-(benzothiazol-2-yldithio)-alpha-(isopropenyl)-4-oxo-3-[(phenoxyacetyl)amino]azetidine-1-acetate (CAS 61585-90-8) — formula C36H31N3O5S3, molecular weight 681.8; category organic chemicals.
| CAS Number | 61585-90-8 |
|---|---|
| Molecular Formula | C36H31N3O5S3 |
| Molecular Weight | 681.8 |
| LogP | 8.3 |
| Category | Organic Chemicals |
benzhydryl 2-(benzothiazol-2-yldithio)-alpha-(isopropenyl)-4-oxo-3-[(phenoxyacetyl)amino]azetidine-1-acetate is a carbon-based organic compound with CAS registry number 61585-90-8 and molecular formula C36H31N3O5S3 (molecular weight 681.8), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 61585-90-8
Its molecular formula C36H31N3O5S3 comprises 36 C, 31 H, 3 N, 5 O, 3 S atoms.
Also known as: benzhydryl 2-(benzothiazol-2-yldithio)-alpha-(isopropenyl)-4-oxo-3-[(phenoxyacetyl)amino]azetidine-1-acetate · 二苯甲基2-(苯并噻唑-2-基二硫代)-α-(异丙烯基)-4-氧代-3-[(苯氧基乙酰基)氨基]氮杂环丁烷-1-乙酸酯
Category: organic chemicals
The CAS registry number of benzhydryl 2-(benzothiazol-2-yldithio)-alpha-(isopropenyl)-4-oxo-3-[(phenoxyacetyl)amino]azetidine-1-acetate is 61585-90-8.
Molecular formula C36H31N3O5S3, molecular weight 681.8.
It is also registered under: benzhydryl 2-(benzothiazol-2-yldithio)-alpha-(isopropenyl)-4-oxo-3-[(phenoxyacetyl)amino]azetidine-1-acetate, 二苯甲基2-(苯并噻唑-2-基二硫代)-α-(异丙烯基)-4-氧代-3-[(苯氧基乙酰基)氨基]氮杂环丁烷-1-乙酸酯.
Category: Organic Chemicals.
Independent reference data for benzhydryl 2-(benzothiazol-2-yldithio)-alpha-(isopropenyl)-4-oxo-3-[(phenoxyacetyl)amino]azetidine-1-acetate (CAS 61585-90-8), compiled from public chemistry databases.
| CAS 号 | 61585-90-8 |
|---|---|
| PubChem CID | 99988 |
| 分子式 | C36H31N3O5S3 |
| IUPAC 名称 | benzhydryl 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-methylbut-3-enoate |
| UNII（FDA） | NS00054558 |
| Molecular Weight | 681.8 |
|---|---|
| XLogP3 | 8.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 14 |
| Exact Mass | 681.14258462 |
| Monoisotopic Mass | 681.14258462 |
| Topological Polar Surface Area | 177 |
| Heavy Atom Count | 47 |
61585-90-8; NSC304143; EINECS 262-860-5; NSC 304143; Benzhydryl 2-(benzothiazol-2-yldithio)-alpha-(isopropenyl)-4-oxo-3-((phenoxyacetyl)amino)azetidine-1-acetate; SCHEMBL10839697; DTXSID10977173; XIWJNWWOPFNDHF-UHFFFAOYSA-N; NSC-304143; NS00054558
二苯甲基2-(苯并噻唑-2-基二硫代)-α-(异丙烯基)-4-氧代-3-[(苯氧基乙酰基)氨基]氮杂环丁烷-1-乙酸酯 · CAS 61585-90-8 · C36H31N3O5S3. UNII NS00054558.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 二苯甲基2-(苯并噻唑-2-基二硫代)-α-(异丙烯基)-4-氧代-3-[(苯氧基乙酰基)氨基]氮杂环丁烷-1-乙酸酯