N-(butan-2-yl)-2-(2-fluorophenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-(butan-2-yl)-2-(2-fluorophenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-(butan-2-yl)-2-(2-fluorophenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V007-9553 |
| Compound Name: | N-(butan-2-yl)-2-(2-fluorophenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 414.41 |
| Molecular Formula: | C21 H20 F2 N4 O3 |
| Smiles: | CCC(C)NC(C1C(N(Cc2ccc(cc2)F)C(N(c2ccccc2F)N=1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1523 |
| logD: | 3.1523 |
| logSw: | -3.4275 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.07 |
| InChI Key: | CIOHUULCXLAIBH-ZDUSSCGKSA-N |