2-(4-chlorophenyl)-N-[(4-fluorophenyl)methyl]-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(4-chlorophenyl)-N-[(4-fluorophenyl)methyl]-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(4-chlorophenyl)-N-[(4-fluorophenyl)methyl]-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V022-9356 |
| Compound Name: | 2-(4-chlorophenyl)-N-[(4-fluorophenyl)methyl]-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 494.91 |
| Molecular Formula: | C25 H20 Cl F N4 O4 |
| Smiles: | COc1cccc(CN2C(C(C(NCc3ccc(cc3)F)=O)=NN(C2=O)c2ccc(cc2)[Cl])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.3294 |
| logD: | 4.2929 |
| logSw: | -4.7169 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.202 |
| InChI Key: | KAWQZCWZVVBSDY-UHFFFAOYSA-N |