2-(3-chlorophenyl)-N-[2-(dimethylamino)ethyl]-4-[(4-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(3-chlorophenyl)-N-[2-(dimethylamino)ethyl]-4-[(4-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(3-chlorophenyl)-N-[2-(dimethylamino)ethyl]-4-[(4-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V013-4356 |
| Compound Name: | 2-(3-chlorophenyl)-N-[2-(dimethylamino)ethyl]-4-[(4-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 441.92 |
| Molecular Formula: | C22 H24 Cl N5 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(CN2C(C(C(NCCN(C)C)=O)=NN(C2=O)c2cccc(c2)[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0538 |
| logD: | 1.9366 |
| logSw: | -3.5547 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.637 |
| InChI Key: | AJIIPFBJKJJWNA-UHFFFAOYSA-N |