N-(3-methylbutyl)-3-{3-[3-(2-methylpropoxy)phenyl]-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl}propanamide
Chemical Structure Depiction of
N-(3-methylbutyl)-3-{3-[3-(2-methylpropoxy)phenyl]-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl}propanamide
N-(3-methylbutyl)-3-{3-[3-(2-methylpropoxy)phenyl]-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl}propanamide
Compound characteristics
| Compound ID: | V010-0443 |
| Compound Name: | N-(3-methylbutyl)-3-{3-[3-(2-methylpropoxy)phenyl]-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl}propanamide |
| Molecular Weight: | 386.49 |
| Molecular Formula: | C21 H30 N4 O3 |
| Salt: | not_available |
| Smiles: | CC(C)CCNC(CCC1C(N=C(c2cccc(c2)OCC(C)C)NN=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0698 |
| logD: | 3.0698 |
| logSw: | -3.3639 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.392 |
| InChI Key: | BALVDAUMFUPVNI-UHFFFAOYSA-N |