5-chloro-N-[(4-methylphenyl)methyl]-2-(propane-1-sulfonyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-[(4-methylphenyl)methyl]-2-(propane-1-sulfonyl)pyrimidine-4-carboxamide
5-chloro-N-[(4-methylphenyl)methyl]-2-(propane-1-sulfonyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D053-0204 |
| Compound Name: | 5-chloro-N-[(4-methylphenyl)methyl]-2-(propane-1-sulfonyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 367.85 |
| Molecular Formula: | C16 H18 Cl N3 O3 S |
| Smiles: | [H]N(Cc1ccc(C)cc1)C(c1c(cnc(n1)S(CCC)(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.79 |
| logD: | 2.7855 |
| logSw: | -3.4953 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.101 |
| InChI Key: | KZGODJPYWBSXGF-UHFFFAOYSA-N |