4-[(3-chlorophenyl)methyl]-N-cyclohexyl-N-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(3-chlorophenyl)methyl]-N-cyclohexyl-N-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(3-chlorophenyl)methyl]-N-cyclohexyl-N-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V006-9451 |
| Compound Name: | 4-[(3-chlorophenyl)methyl]-N-cyclohexyl-N-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 466.97 |
| Molecular Formula: | C25 H27 Cl N4 O3 |
| Smiles: | Cc1ccc(cc1)N1C(N(Cc2cccc(c2)[Cl])C(C(C(N(C)C2CCCCC2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0456 |
| logD: | 5.0456 |
| logSw: | -4.9865 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.447 |
| InChI Key: | JPFWRJNQEWMFJI-UHFFFAOYSA-N |