AC1N2R3H
3,4,5-trimethoxy-N-[5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: Oprea1_364148|AB00684285-01|F0417-1448|3,4,5-trimethoxy-N-(5-((2-oxo-2-(thiazol-2-ylamino)ethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide|3,4,5-trimethoxy-N-[5-({[(1,3-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide|3,4,5-trimethoxy-N-[5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide|3,4,5-trimethoxy-N-[5-(1,3-thiazol-2-ylcarbamoylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide
| Molecular Formula | C17H17N5O5S3 |
|---|---|
| Molecular Weight | 467.03918 g/mol |
| LogP | 3.0035 |
| Topological Polar Surface Area | 124.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 467.03918 |
| Monoisotopic Mass | 467.03918 |
| Heavy Atoms | 30 |
| Complexity | 999.7229 |
Chemical Identifiers
| CAS Number | 392299-83-1 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NN=C(S2)SCC(=O)NC3=NC=CS3 |
Product Overview
AC1N2R3H (CAS 392299-83-1), with molecular formula C17H17N5O5S3 and molecular weight 467.03918 g/mol. IUPAC: 3,4,5-trimethoxy-N-[5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.
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