3-(3-{3-[(butan-2-yl)oxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-(1-phenylethyl)propanamide
Chemical Structure Depiction of
3-(3-{3-[(butan-2-yl)oxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-(1-phenylethyl)propanamide
3-(3-{3-[(butan-2-yl)oxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-(1-phenylethyl)propanamide
Compound characteristics
| Compound ID: | V021-0505 |
| Compound Name: | 3-(3-{3-[(butan-2-yl)oxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-(1-phenylethyl)propanamide |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C24 H28 N4 O3 |
| Salt: | not_available |
| Smiles: | CCC(C)Oc1cccc(c1)C1NN=C(CCC(NC(C)c2ccccc2)=O)C(N=1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.537 |
| logD: | 3.537 |
| logSw: | -3.7221 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.629 |
| InChI Key: | JELKSHYQBKIZKD-UHFFFAOYSA-N |