2-(4-chlorophenyl)-4-methyl-N-({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(4-chlorophenyl)-4-methyl-N-({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(4-chlorophenyl)-4-methyl-N-({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | G674-0682 |
| Compound Name: | 2-(4-chlorophenyl)-4-methyl-N-({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 481.98 |
| Molecular Formula: | C25 H28 Cl N5 O3 |
| Smiles: | Cc1ccc(CN2CCC(CC2)CNC(C2C(N(C)C(N(c3ccc(cc3)[Cl])N=2)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7997 |
| logD: | 1.0786 |
| logSw: | -4.3371 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.428 |
| InChI Key: | MMXDLMKVAPVPEO-UHFFFAOYSA-N |