4-tert-butyl-N-(4-chlorophenyl)-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzamide
Chemical Structure Depiction of
4-tert-butyl-N-(4-chlorophenyl)-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzamide
4-tert-butyl-N-(4-chlorophenyl)-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzamide
Compound characteristics
Compound ID: | D433-0232 |
Compound Name: | 4-tert-butyl-N-(4-chlorophenyl)-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzamide |
Molecular Weight: | 447.97 |
Molecular Formula: | C25 H26 Cl N5 O |
Smiles: | Cc1cc(C)n2c(n1)nc(CN(C(c1ccc(cc1)C(C)(C)C)=O)c1ccc(cc1)[Cl])n2 |
Stereo: | ACHIRAL |
logP: | 5.3033 |
logD: | 5.3033 |
logSw: | -5.895 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 47.171 |
InChI Key: | SPFAQTCBMNFHBV-UHFFFAOYSA-N |