N-benzyl-3-{1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
Chemical Structure Depiction of
N-benzyl-3-{1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
N-benzyl-3-{1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
Compound characteristics
| Compound ID: | C241-1295 |
| Compound Name: | N-benzyl-3-{1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide |
| Molecular Weight: | 527 |
| Molecular Formula: | C25 H23 Cl N4 O5 S |
| Smiles: | COc1ccc(cc1NC(CN1C(N(CCC(NCc2ccccc2)=O)C(c2c1ccs2)=O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4691 |
| logD: | 3.4656 |
| logSw: | -3.914 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.817 |
| InChI Key: | AKHGLKARALVDFG-UHFFFAOYSA-N |