5-amino-1-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-N-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-1-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-N-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-1-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-N-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C368-0293 |
| Compound Name: | 5-amino-1-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-N-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 440.46 |
| Molecular Formula: | C21 H24 N6 O5 |
| Smiles: | COc1cccc(CNC(c2c(N)n(CC(Nc3cc(cc(c3)OC)OC)=O)nn2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 1.5164 |
| logD: | 1.5162 |
| logSw: | -2.1637 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 116.39 |
| InChI Key: | CDKOIEHIMMQMER-UHFFFAOYSA-N |