5-chloro-N-(3,4-dimethylphenyl)-2-[(4-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(3,4-dimethylphenyl)-2-[(4-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide
5-chloro-N-(3,4-dimethylphenyl)-2-[(4-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0321 |
| Compound Name: | 5-chloro-N-(3,4-dimethylphenyl)-2-[(4-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide |
| Molecular Weight: | 433.89 |
| Molecular Formula: | C20 H17 Cl F N3 O3 S |
| Smiles: | [H]N(C(c1c(cnc(n1)S(Cc1ccc(cc1)F)(=O)=O)[Cl])=O)c1ccc(C)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.3701 |
| logD: | 4.3581 |
| logSw: | -4.3722 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.507 |
| InChI Key: | IPEOEHLRMMOZKY-UHFFFAOYSA-N |