N-[(4-fluorophenyl)methyl]-3-[5-oxo-3-(thiophen-2-yl)-2,5-dihydro-1,2,4-triazin-6-yl]propanamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-3-[5-oxo-3-(thiophen-2-yl)-2,5-dihydro-1,2,4-triazin-6-yl]propanamide
N-[(4-fluorophenyl)methyl]-3-[5-oxo-3-(thiophen-2-yl)-2,5-dihydro-1,2,4-triazin-6-yl]propanamide
Compound characteristics
| Compound ID: | V022-7649 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-3-[5-oxo-3-(thiophen-2-yl)-2,5-dihydro-1,2,4-triazin-6-yl]propanamide |
| Molecular Weight: | 358.39 |
| Molecular Formula: | C17 H15 F N4 O2 S |
| Smiles: | C(CC(NCc1ccc(cc1)F)=O)C1C(N=C(c2cccs2)NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7527 |
| logD: | 1.2799 |
| logSw: | -2.2663 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.798 |
| InChI Key: | NRZMHQDXEKPGGA-UHFFFAOYSA-N |