N-(1H-benzimidazol-2-yl)-2-({[4-oxo-6-(propan-2-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]methyl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(1H-benzimidazol-2-yl)-2-({[4-oxo-6-(propan-2-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]methyl}sulfanyl)acetamide
N-(1H-benzimidazol-2-yl)-2-({[4-oxo-6-(propan-2-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]methyl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | Y042-4253 |
| Compound Name: | N-(1H-benzimidazol-2-yl)-2-({[4-oxo-6-(propan-2-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]methyl}sulfanyl)acetamide |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C19 H19 N5 O2 S2 |
| Smiles: | CC(C)c1cc2C(NC(CSCC(Nc3nc4ccccc4[nH]3)=O)=Nc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0863 |
| logD: | 3.0858 |
| logSw: | -3.534 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.377 |
| InChI Key: | YCAGKBVICPHHEX-UHFFFAOYSA-N |