N-[(4-methylphenyl)methyl]-3-(4-oxo-2-sulfanylidene-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)propanamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-3-(4-oxo-2-sulfanylidene-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)propanamide
N-[(4-methylphenyl)methyl]-3-(4-oxo-2-sulfanylidene-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)propanamide
Compound characteristics
| Compound ID: | K292-1861 |
| Compound Name: | N-[(4-methylphenyl)methyl]-3-(4-oxo-2-sulfanylidene-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)propanamide |
| Molecular Weight: | 359.47 |
| Molecular Formula: | C17 H17 N3 O2 S2 |
| Smiles: | Cc1ccc(CNC(CCN2C(c3c(ccs3)NC2=S)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7069 |
| logD: | 2.7062 |
| logSw: | -3.0702 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.786 |
| InChI Key: | HBNLDLGNOPLJFA-UHFFFAOYSA-N |