2-({4-oxo-3-[(pyridin-2-yl)methyl]-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-({4-oxo-3-[(pyridin-2-yl)methyl]-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
2-({4-oxo-3-[(pyridin-2-yl)methyl]-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | K292-1976 |
| Compound Name: | 2-({4-oxo-3-[(pyridin-2-yl)methyl]-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide |
| Molecular Weight: | 515.63 |
| Molecular Formula: | C22 H21 N5 O4 S3 |
| Smiles: | C(CNC(CSC1=Nc2ccsc2C(N1Cc1ccccn1)=O)=O)c1ccc(cc1)S(N)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9171 |
| logD: | 0.9163 |
| logSw: | -2.2998 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 111.249 |
| InChI Key: | FGXIQNMIHHZUCY-UHFFFAOYSA-N |