N-benzyl-5-chloro-N-(4-ethoxyphenyl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-benzyl-5-chloro-N-(4-ethoxyphenyl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
N-benzyl-5-chloro-N-(4-ethoxyphenyl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0344 |
| Compound Name: | N-benzyl-5-chloro-N-(4-ethoxyphenyl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 427.95 |
| Molecular Formula: | C22 H22 Cl N3 O2 S |
| Smiles: | CCOc1ccc(cc1)N(Cc1ccccc1)C(c1c(cnc(n1)SCC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.741 |
| logD: | 5.741 |
| logSw: | -5.8138 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.299 |
| InChI Key: | SKGPUXYBOSKHFH-UHFFFAOYSA-N |