N-[(4-fluorophenyl)methyl]-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2-[4-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2-[4-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-[(4-fluorophenyl)methyl]-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2-[4-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V010-6044 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2-[4-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 528.46 |
| Molecular Formula: | C26 H20 F4 N4 O4 |
| Salt: | not_available |
| Smiles: | COc1cccc(CN2C(C(C(NCc3ccc(cc3)F)=O)=NN(C2=O)c2ccc(cc2)C(F)(F)F)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.6075 |
| logD: | 4.5709 |
| logSw: | -4.4191 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.202 |
| InChI Key: | PDKQKJNWSKNGGU-UHFFFAOYSA-N |