5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide
5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide
Compound characteristics
Compound ID: | D233-0453 |
Compound Name: | 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide |
Molecular Weight: | 493.94 |
Molecular Formula: | C22 H21 Cl F N3 O5 S |
Smiles: | [H]N(CCc1ccc(c(c1)OC)OC)C(c1c(cnc(n1)S(Cc1ccccc1F)(=O)=O)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 2.9375 |
logD: | 2.9374 |
logSw: | -3.4605 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.932 |
InChI Key: | LHPSHGJGWQTYFY-UHFFFAOYSA-N |