N-[(4-fluorophenyl)methyl]-3-{3-[(2-methoxyphenyl)methyl]-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl}propanamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-3-{3-[(2-methoxyphenyl)methyl]-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl}propanamide
N-[(4-fluorophenyl)methyl]-3-{3-[(2-methoxyphenyl)methyl]-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl}propanamide
Compound characteristics
| Compound ID: | V004-0048 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-3-{3-[(2-methoxyphenyl)methyl]-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl}propanamide |
| Molecular Weight: | 396.42 |
| Molecular Formula: | C21 H21 F N4 O3 |
| Salt: | not_available |
| Smiles: | COc1ccccc1CC1NN=C(CCC(NCc2ccc(cc2)F)=O)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1975 |
| logD: | 2.0187 |
| logSw: | -2.4996 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.419 |
| InChI Key: | XZQBXCSPNZJSNJ-UHFFFAOYSA-N |