5-chloro-2-(methylsulfanyl)-N-(pyridin-3-yl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-(methylsulfanyl)-N-(pyridin-3-yl)pyrimidine-4-carboxamide
5-chloro-2-(methylsulfanyl)-N-(pyridin-3-yl)pyrimidine-4-carboxamide
Compound characteristics
Compound ID: | D054-0025 |
Compound Name: | 5-chloro-2-(methylsulfanyl)-N-(pyridin-3-yl)pyrimidine-4-carboxamide |
Molecular Weight: | 280.73 |
Molecular Formula: | C11 H9 Cl N4 O S |
Smiles: | [H]N(C(c1c(cnc(n1)SC)[Cl])=O)c1cccnc1 |
Stereo: | ACHIRAL |
logP: | 2.2629 |
logD: | 2.2596 |
logSw: | -3.0854 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.433 |
InChI Key: | QTHZLYHZGGWBQD-UHFFFAOYSA-N |