3-{3-[3-(2-methylpropoxy)phenyl]-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl}-N-(1-phenylethyl)propanamide
Chemical Structure Depiction of
3-{3-[3-(2-methylpropoxy)phenyl]-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl}-N-(1-phenylethyl)propanamide
3-{3-[3-(2-methylpropoxy)phenyl]-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl}-N-(1-phenylethyl)propanamide
Compound characteristics
| Compound ID: | V004-4422 |
| Compound Name: | 3-{3-[3-(2-methylpropoxy)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: | CC(C)COc1cccc(c1)C1NN=C(CCC(NC(C)c2ccccc2)=O)C(N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5594 |
| logD: | 3.5594 |
| logSw: | -3.8121 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.442 |
| InChI Key: | QMXLPSKREMGCLP-KRWDZBQOSA-N |