N-benzyl-5-chloro-2-(ethylsulfanyl)-N-(4-methoxyphenyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-benzyl-5-chloro-2-(ethylsulfanyl)-N-(4-methoxyphenyl)pyrimidine-4-carboxamide
N-benzyl-5-chloro-2-(ethylsulfanyl)-N-(4-methoxyphenyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0343 |
| Compound Name: | N-benzyl-5-chloro-2-(ethylsulfanyl)-N-(4-methoxyphenyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 413.92 |
| Molecular Formula: | C21 H20 Cl N3 O2 S |
| Smiles: | CCSc1ncc(c(C(N(Cc2ccccc2)c2ccc(cc2)OC)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.3545 |
| logD: | 5.3545 |
| logSw: | -5.8107 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.719 |
| InChI Key: | QGBAZSORNFOYNL-UHFFFAOYSA-N |