N-[2-(4-chlorophenyl)ethyl]-3-{1-[2-(3-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-3-{1-[2-(3-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
N-[2-(4-chlorophenyl)ethyl]-3-{1-[2-(3-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
Compound characteristics
| Compound ID: | C241-2161 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-3-{1-[2-(3-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide |
| Molecular Weight: | 541.02 |
| Molecular Formula: | C26 H25 Cl N4 O5 S |
| Smiles: | COc1cccc(c1)NC(CN1C(N(CCC(NCCc2ccc(cc2)[Cl])=O)C(c2c1ccs2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6521 |
| logD: | 3.6521 |
| logSw: | -4.1612 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.27 |
| InChI Key: | MQBJRLLBAZGEEB-UHFFFAOYSA-N |