N-(4-bromo-2-methylphenyl)-2,5-dimethyl-4-(piperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-2,5-dimethyl-4-(piperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
N-(4-bromo-2-methylphenyl)-2,5-dimethyl-4-(piperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
Compound ID: | K889-0156 |
Compound Name: | N-(4-bromo-2-methylphenyl)-2,5-dimethyl-4-(piperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide |
Molecular Weight: | 459.41 |
Molecular Formula: | C21 H23 Br N4 O S |
Smiles: | Cc1cc(ccc1NC(c1c(C)c2c(nc(C)nc2s1)N1CCCCC1)=O)[Br] |
Stereo: | ACHIRAL |
logP: | 5.8401 |
logD: | 5.7871 |
logSw: | -5.6222 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 45.306 |
InChI Key: | QVMJOJMABRWEHL-UHFFFAOYSA-N |