N-[2-{[1-(3-chloroanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-3-methoxybenzamide
Chemical Structure Depiction of
N-[2-{[1-(3-chloroanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-3-methoxybenzamide
N-[2-{[1-(3-chloroanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-3-methoxybenzamide
Compound characteristics
| Compound ID: | K292-1913 |
| Compound Name: | N-[2-{[1-(3-chloroanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-3-methoxybenzamide |
| Molecular Weight: | 529.04 |
| Molecular Formula: | C24 H21 Cl N4 O4 S2 |
| Smiles: | CCC(C(Nc1cccc(c1)[Cl])=O)SC1=Nc2ccsc2C(N1NC(c1cccc(c1)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9684 |
| logD: | 4.9681 |
| logSw: | -5.0227 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.097 |
| InChI Key: | BTHGBHPZMFZETC-IBGZPJMESA-N |