N-(2-methoxyphenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]butanamide
Chemical Structure Depiction of
N-(2-methoxyphenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]butanamide
N-(2-methoxyphenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | D433-1153 |
| Compound Name: | N-(2-methoxyphenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]butanamide |
| Molecular Weight: | 355.39 |
| Molecular Formula: | C18 H21 N5 O3 |
| Smiles: | CCCC(N(Cc1nc2NC(C)=CC(n2n1)=O)c1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1045 |
| logD: | -0.5482 |
| logSw: | -2.7239 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.42 |
| InChI Key: | KCDGAVNIYICSIL-UHFFFAOYSA-N |