N-(4-chloro-2-fluorophenyl)-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-chloro-2-fluorophenyl)-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
N-(4-chloro-2-fluorophenyl)-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F396-1279 |
| Compound Name: | N-(4-chloro-2-fluorophenyl)-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 491 |
| Molecular Formula: | C22 H20 Cl F N4 O2 S2 |
| Smiles: | CC(C)CCN1C(=Nc2c3cccnc3sc2C1=O)SCC(Nc1ccc(cc1F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2505 |
| logD: | 5.2455 |
| logSw: | -5.7902 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.373 |
| InChI Key: | BNJVVGXXMAHSLT-UHFFFAOYSA-N |