N-[(4-fluorophenyl)methyl]-3-(5-oxo-3-{3-[(propan-2-yl)oxy]phenyl}-2,5-dihydro-1,2,4-triazin-6-yl)propanamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-3-(5-oxo-3-{3-[(propan-2-yl)oxy]phenyl}-2,5-dihydro-1,2,4-triazin-6-yl)propanamide
N-[(4-fluorophenyl)methyl]-3-(5-oxo-3-{3-[(propan-2-yl)oxy]phenyl}-2,5-dihydro-1,2,4-triazin-6-yl)propanamide
Compound characteristics
| Compound ID: | V021-4753 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-3-(5-oxo-3-{3-[(propan-2-yl)oxy]phenyl}-2,5-dihydro-1,2,4-triazin-6-yl)propanamide |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C22 H23 F N4 O3 |
| Smiles: | CC(C)Oc1cccc(c1)C1NN=C(CCC(NCc2ccc(cc2)F)=O)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5633 |
| logD: | 2.5633 |
| logSw: | -2.8064 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.582 |
| InChI Key: | OMOAFDFNOOBISB-UHFFFAOYSA-N |