N-(6-benzyl-7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3-chlorobenzamide
Chemical Structure Depiction of
N-(6-benzyl-7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3-chlorobenzamide
N-(6-benzyl-7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3-chlorobenzamide
Compound characteristics
| Compound ID: | D205-0339 |
| Compound Name: | N-(6-benzyl-7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3-chlorobenzamide |
| Molecular Weight: | 393.83 |
| Molecular Formula: | C20 H16 Cl N5 O2 |
| Smiles: | Cc1c(Cc2ccccc2)c(n2c(n1)nc(NC(c1cccc(c1)[Cl])=O)n2)O |
| Stereo: | ACHIRAL |
| logP: | 3.5268 |
| logD: | 2.9081 |
| logSw: | -3.9386 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.761 |
| InChI Key: | JHTXLDOUBYGTMZ-UHFFFAOYSA-N |