N-(2-oxo-2H-1-benzopyran-6-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-(2-oxo-2H-1-benzopyran-6-yl)-2-({[4-oxo-6-(propan-2-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]methyl}sulfanyl)acetamide
N-(2-oxo-2H-1-benzopyran-6-yl)-2-({[4-oxo-6-(propan-2-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]methyl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | Y042-4252 |
| Compound Name: | N-(2-oxo-2H-1-benzopyran-6-yl)-2-({[4-oxo-6-(propan-2-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]methyl}sulfanyl)acetamide |
| Molecular Weight: | 441.53 |
| Molecular Formula: | C21 H19 N3 O4 S2 |
| Smiles: | CC(C)c1cc2C(NC(CSCC(Nc3ccc4c(C=CC(=O)O4)c3)=O)=Nc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2886 |
| logD: | 3.2881 |
| logSw: | -3.823 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.359 |
| InChI Key: | WMWDISUNJJEQGC-UHFFFAOYSA-N |