4-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-N-(propan-2-yl)-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-N-(propan-2-yl)-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-N-(propan-2-yl)-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V012-3859 |
| Compound Name: | 4-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-N-(propan-2-yl)-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 428.87 |
| Molecular Formula: | C21 H21 Cl N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)NC(C1C(N(Cc2ccccc2[Cl])C(N(c2cccc(c2)OC)N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6431 |
| logD: | 3.643 |
| logSw: | -3.951 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.448 |
| InChI Key: | BHYNVYMYBXHSJS-UHFFFAOYSA-N |