5-chloro-2-[(prop-2-en-1-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-[(prop-2-en-1-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
5-chloro-2-[(prop-2-en-1-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
Compound characteristics
Compound ID: | D233-0138 |
Compound Name: | 5-chloro-2-[(prop-2-en-1-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide |
Molecular Weight: | 373.78 |
Molecular Formula: | C15 H11 Cl F3 N3 O S |
Smiles: | [H]N(C(c1c(cnc(n1)SCC=C)[Cl])=O)c1ccccc1C(F)(F)F |
Stereo: | ACHIRAL |
logP: | 4.7108 |
logD: | 4.7089 |
logSw: | -4.9646 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 41.217 |
InChI Key: | WVYVSSLAAZUJLR-UHFFFAOYSA-N |