3-{1-[(3-chlorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methoxyphenyl)methyl]propanamide
Chemical Structure Depiction of
3-{1-[(3-chlorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methoxyphenyl)methyl]propanamide
3-{1-[(3-chlorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methoxyphenyl)methyl]propanamide
Compound characteristics
| Compound ID: | C241-1500 |
| Compound Name: | 3-{1-[(3-chlorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methoxyphenyl)methyl]propanamide |
| Molecular Weight: | 483.97 |
| Molecular Formula: | C24 H22 Cl N3 O4 S |
| Smiles: | COc1ccc(CNC(CCN2C(c3c(ccs3)N(Cc3cccc(c3)[Cl])C2=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4482 |
| logD: | 4.4482 |
| logSw: | -4.5404 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.279 |
| InChI Key: | LBKIFPPFWAFCSO-UHFFFAOYSA-N |