2-chloro-N-(4-methoxyphenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzamide
Chemical Structure Depiction of
2-chloro-N-(4-methoxyphenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzamide
2-chloro-N-(4-methoxyphenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | D433-0924 |
| Compound Name: | 2-chloro-N-(4-methoxyphenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzamide |
| Molecular Weight: | 423.86 |
| Molecular Formula: | C21 H18 Cl N5 O3 |
| Smiles: | CC1=CC(n2c(N1)nc(CN(C(c1ccccc1[Cl])=O)c1ccc(cc1)OC)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8431 |
| logD: | 0.1905 |
| logSw: | -3.6776 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.891 |
| InChI Key: | KVUYVCTZJQKZTF-UHFFFAOYSA-N |