N-benzyl-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-benzyl-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V026-4675 |
| Compound Name: | N-benzyl-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 442.47 |
| Molecular Formula: | C25 H22 N4 O4 |
| Smiles: | COc1cccc(CN2C(C(C(NCc3ccccc3)=O)=NN(C2=O)c2ccccc2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.5841 |
| logD: | 3.5699 |
| logSw: | -3.8371 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.202 |
| InChI Key: | WNMCQMDJUYSMLM-UHFFFAOYSA-N |