N-benzyl-3-[3-(4-butoxyphenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]propanamide
Chemical Structure Depiction of
N-benzyl-3-[3-(4-butoxyphenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]propanamide
N-benzyl-3-[3-(4-butoxyphenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]propanamide
Compound characteristics
| Compound ID: | V011-4635 |
| Compound Name: | N-benzyl-3-[3-(4-butoxyphenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]propanamide |
| Molecular Weight: | 406.48 |
| Molecular Formula: | C23 H26 N4 O3 |
| Salt: | not_available |
| Smiles: | CCCCOc1ccc(cc1)C1NN=C(CCC(NCc2ccccc2)=O)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.349 |
| logD: | 2.4078 |
| logSw: | -3.4592 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.197 |
| InChI Key: | JMKLZJMJQYFQOE-UHFFFAOYSA-N |