2-(3-chloro-4-methylphenyl)-N,N-diethyl-4-[(3-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(3-chloro-4-methylphenyl)-N,N-diethyl-4-[(3-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(3-chloro-4-methylphenyl)-N,N-diethyl-4-[(3-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V009-3447 |
| Compound Name: | 2-(3-chloro-4-methylphenyl)-N,N-diethyl-4-[(3-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 444.89 |
| Molecular Formula: | C22 H22 Cl F N4 O3 |
| Smiles: | CCN(CC)C(C1C(N(Cc2cccc(c2)F)C(N(c2ccc(C)c(c2)[Cl])N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2696 |
| logD: | 4.2696 |
| logSw: | -4.4747 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.177 |
| InChI Key: | VONVVYYODUXMDD-UHFFFAOYSA-N |