ethyl 2-(benzylsulfanyl)-4-[(3,4-dichlorophenyl)carbamamido]pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 2-(benzylsulfanyl)-4-[(3,4-dichlorophenyl)carbamamido]pyrimidine-5-carboxylate
ethyl 2-(benzylsulfanyl)-4-[(3,4-dichlorophenyl)carbamamido]pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8451-04821 |
| Compound Name: | ethyl 2-(benzylsulfanyl)-4-[(3,4-dichlorophenyl)carbamamido]pyrimidine-5-carboxylate |
| Molecular Weight: | 477.37 |
| Molecular Formula: | C21 H18 Cl2 N4 O3 S |
| Smiles: | CCOC(c1cnc(nc1NC(Nc1ccc(c(c1)[Cl])[Cl])=O)SCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2239 |
| logD: | 4.2281 |
| logSw: | -6.0202 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.478 |
| InChI Key: | QZJQRLOJKGGPFQ-UHFFFAOYSA-N |