N-(cyclopropylmethyl)-2-(4-fluorophenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-(cyclopropylmethyl)-2-(4-fluorophenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-(cyclopropylmethyl)-2-(4-fluorophenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V031-0258 |
| Compound Name: | N-(cyclopropylmethyl)-2-(4-fluorophenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 412.39 |
| Molecular Formula: | C21 H18 F2 N4 O3 |
| Salt: | not_available |
| Smiles: | C1CC1CNC(C1C(N(Cc2ccc(cc2)F)C(N(c2ccc(cc2)F)N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0391 |
| logD: | 3.0391 |
| logSw: | -3.2986 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.181 |
| InChI Key: | AOICMKGTQNRNTM-UHFFFAOYSA-N |