N-[2-{[1-(5-chloro-2-methylanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-3-methoxybenzamide
Chemical Structure Depiction of
N-[2-{[1-(5-chloro-2-methylanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-3-methoxybenzamide
N-[2-{[1-(5-chloro-2-methylanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-3-methoxybenzamide
Compound characteristics
| Compound ID: | K292-1919 |
| Compound Name: | N-[2-{[1-(5-chloro-2-methylanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-3-methoxybenzamide |
| Molecular Weight: | 543.06 |
| Molecular Formula: | C25 H23 Cl N4 O4 S2 |
| Smiles: | CCC(C(Nc1cc(ccc1C)[Cl])=O)SC1=Nc2ccsc2C(N1NC(c1cccc(c1)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9705 |
| logD: | 4.9702 |
| logSw: | -5.0908 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.399 |
| InChI Key: | CWVJGUZYYKZEAJ-FQEVSTJZSA-N |