N-benzyl-4-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-4-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-benzyl-4-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V005-8983 |
| Compound Name: | N-benzyl-4-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 476.92 |
| Molecular Formula: | C25 H21 Cl N4 O4 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)N1C(N(Cc2ccccc2[Cl])C(C(C(NCc2ccccc2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3029 |
| logD: | 4.2886 |
| logSw: | -4.5299 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.202 |
| InChI Key: | OHBIEQBSHSYDAM-UHFFFAOYSA-N |