5-amino-N-(2,5-dimethylphenyl)-1-[2-(2-methoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-(2,5-dimethylphenyl)-1-[2-(2-methoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-N-(2,5-dimethylphenyl)-1-[2-(2-methoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | E919-2691 |
| Compound Name: | 5-amino-N-(2,5-dimethylphenyl)-1-[2-(2-methoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 394.43 |
| Molecular Formula: | C20 H22 N6 O3 |
| Smiles: | Cc1ccc(C)c(c1)NC(c1c(N)n(CC(Nc2ccccc2OC)=O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6813 |
| logD: | 1.6812 |
| logSw: | -2.3748 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 98.672 |
| InChI Key: | UOCFRZTXIBAPHK-UHFFFAOYSA-N |