N-[2-(4-chlorophenyl)ethyl]-3-[2-(3,5-dimethoxyphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-3-[2-(3,5-dimethoxyphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide
N-[2-(4-chlorophenyl)ethyl]-3-[2-(3,5-dimethoxyphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide
Compound characteristics
| Compound ID: | C561-1814 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-3-[2-(3,5-dimethoxyphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide |
| Molecular Weight: | 493.99 |
| Molecular Formula: | C26 H28 Cl N5 O3 |
| Smiles: | Cc1c(CCC(NCCc2ccc(cc2)[Cl])=O)c(C)n2c(n1)nc(c1cc(cc(c1)OC)OC)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.7928 |
| logD: | 3.6617 |
| logSw: | -4.4618 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.233 |
| InChI Key: | WDMBRJXXYRKINN-UHFFFAOYSA-N |