AC1N4DE6
3,5-dimethoxy-N-[5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: Oprea1_297049|F0417-1447|3,5-dimethoxy-N-[5-({[(1,3-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide|3,5-dimethoxy-N-(5-((2-oxo-2-(thiazol-2-ylamino)ethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide|3,5-dimethoxy-N-[5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide|3,5-dimethoxy-N-[5-(1,3-thiazol-2-ylcarbamoylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide
| Molecular Formula | C16H15N5O4S3 |
|---|---|
| Molecular Weight | 437.02863 g/mol |
| LogP | 2.9949 |
| Topological Polar Surface Area | 115.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 437.02863 |
| Monoisotopic Mass | 437.02863 |
| Heavy Atoms | 28 |
| Complexity | 938.8577 |
Chemical Identifiers
| CAS Number | 392299-82-0 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=NC=CS3)OC |
Product Overview
AC1N4DE6 (CAS 392299-82-0), with molecular formula C16H15N5O4S3 and molecular weight 437.02863 g/mol. IUPAC: 3,5-dimethoxy-N-[5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.
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