N-[(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-4-fluoro-N-phenylbenzamide
Chemical Structure Depiction of
N-[(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-4-fluoro-N-phenylbenzamide
N-[(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-4-fluoro-N-phenylbenzamide
Compound characteristics
| Compound ID: | D433-0666 |
| Compound Name: | N-[(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-4-fluoro-N-phenylbenzamide |
| Molecular Weight: | 409.85 |
| Molecular Formula: | C21 H17 Cl F N5 O |
| Smiles: | Cc1c(c(C)n2c(n1)nc(CN(C(c1ccc(cc1)F)=O)c1ccccc1)n2)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.6179 |
| logD: | 3.6179 |
| logSw: | -4.234 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.718 |
| InChI Key: | PTSYHAZUSPKDTJ-UHFFFAOYSA-N |