N-[5-(4-chlorophenyl)-7-(4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propanamide
Chemical Structure Depiction of
N-[5-(4-chlorophenyl)-7-(4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propanamide
N-[5-(4-chlorophenyl)-7-(4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propanamide
Compound characteristics
Compound ID: | D413-0087 |
Compound Name: | N-[5-(4-chlorophenyl)-7-(4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propanamide |
Molecular Weight: | 409.87 |
Molecular Formula: | C21 H20 Cl N5 O2 |
Smiles: | CCC(Nc1nc2NC(=CC(c3ccc(cc3)OC)n2n1)c1ccc(cc1)[Cl])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.4598 |
logD: | 4.4582 |
logSw: | -4.858 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 69.486 |
InChI Key: | NNVMJDSHXOKNOJ-GOSISDBHSA-N |