2-(3,5-dimethylphenyl)-N-[(furan-2-yl)methyl]-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(3,5-dimethylphenyl)-N-[(furan-2-yl)methyl]-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(3,5-dimethylphenyl)-N-[(furan-2-yl)methyl]-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V020-7253 |
| Compound Name: | 2-(3,5-dimethylphenyl)-N-[(furan-2-yl)methyl]-4-[(3-methoxyphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 460.49 |
| Molecular Formula: | C25 H24 N4 O5 |
| Smiles: | Cc1cc(C)cc(c1)N1C(N(Cc2cccc(c2)OC)C(C(C(NCc2ccco2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4724 |
| logD: | 4.451 |
| logSw: | -4.4099 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.951 |
| InChI Key: | XCAGKHXGZHNZGH-UHFFFAOYSA-N |