4-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-N-[(pyridin-2-yl)methyl]-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-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V001-0076 |
| Compound Name: | 4-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 477.91 |
| Molecular Formula: | C24 H20 Cl N5 O4 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)N1C(N(Cc2ccccc2[Cl])C(C(C(NCc2ccccn2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.393 |
| logD: | 3.3708 |
| logSw: | -3.6166 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.745 |
| InChI Key: | ZWWAZRBRBPTFAD-UHFFFAOYSA-N |