N-[(4-chlorophenyl)methyl]-2-{[3-(2-methylpropyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-{[3-(2-methylpropyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
N-[(4-chlorophenyl)methyl]-2-{[3-(2-methylpropyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F396-1194 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-{[3-(2-methylpropyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 473.01 |
| Molecular Formula: | C22 H21 Cl N4 O2 S2 |
| Smiles: | CC(C)CN1C(=Nc2c3cccnc3sc2C1=O)SCC(NCc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5673 |
| logD: | 4.5673 |
| logSw: | -4.732 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.415 |
| InChI Key: | DITPAJXOIYJYOS-UHFFFAOYSA-N |