2-(3-chloro-4-methylphenyl)-4-[(2-methylphenyl)methyl]-3,5-dioxo-N-[(pyridin-4-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(3-chloro-4-methylphenyl)-4-[(2-methylphenyl)methyl]-3,5-dioxo-N-[(pyridin-4-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(3-chloro-4-methylphenyl)-4-[(2-methylphenyl)methyl]-3,5-dioxo-N-[(pyridin-4-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V023-5627 |
| Compound Name: | 2-(3-chloro-4-methylphenyl)-4-[(2-methylphenyl)methyl]-3,5-dioxo-N-[(pyridin-4-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 475.93 |
| Molecular Formula: | C25 H22 Cl N5 O3 |
| Smiles: | Cc1ccccc1CN1C(C(C(NCc2ccncc2)=O)=NN(C1=O)c1ccc(C)c(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.172 |
| logD: | 4.1634 |
| logSw: | -4.4906 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.086 |
| InChI Key: | SEMCODLROWYAAE-UHFFFAOYSA-N |