N-(3-chlorophenyl)-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-3,4-dimethoxybenzamide
N-(3-chlorophenyl)-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | D433-0369 |
| Compound Name: | N-(3-chlorophenyl)-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-3,4-dimethoxybenzamide |
| Molecular Weight: | 451.91 |
| Molecular Formula: | C23 H22 Cl N5 O3 |
| Smiles: | Cc1cc(C)n2c(n1)nc(CN(C(c1ccc(c(c1)OC)OC)=O)c1cccc(c1)[Cl])n2 |
| Stereo: | ACHIRAL |
| logP: | 3.0687 |
| logD: | 3.0687 |
| logSw: | -3.3189 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.432 |
| InChI Key: | AQKYCGVDJQXRNO-UHFFFAOYSA-N |