N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)sulfanyl]acetamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D467-0009 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 386.49 |
| Molecular Formula: | C18 H18 N4 O2 S2 |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(CSC1NC(C3CCCC=3N=1)=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.2769 |
| logD: | 1.418 |
| logSw: | -2.4397 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.758 |
| InChI Key: | WZSGYTFIDICYOA-UHFFFAOYSA-N |