4-[(2-chlorophenyl)methyl]-N-(cyclopropylmethyl)-2-(3-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(2-chlorophenyl)methyl]-N-(cyclopropylmethyl)-2-(3-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(2-chlorophenyl)methyl]-N-(cyclopropylmethyl)-2-(3-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V021-4407 |
| Compound Name: | 4-[(2-chlorophenyl)methyl]-N-(cyclopropylmethyl)-2-(3-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 424.89 |
| Molecular Formula: | C22 H21 Cl N4 O3 |
| Smiles: | Cc1cccc(c1)N1C(N(Cc2ccccc2[Cl])C(C(C(NCC2CC2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9681 |
| logD: | 3.9681 |
| logSw: | -4.1935 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.181 |
| InChI Key: | NMBLKYSDBQFIJQ-UHFFFAOYSA-N |