5-amino-1-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-(2,6-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-1-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-(2,6-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide
5-amino-1-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-(2,6-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C368-0338 |
| Compound Name: | 5-amino-1-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-(2,6-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 392.46 |
| Molecular Formula: | C21 H24 N6 O2 |
| Smiles: | Cc1cccc(C)c1NC(Cn1c(c(C(Nc2c(C)cccc2C)=O)nn1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9208 |
| logD: | 1.9207 |
| logSw: | -2.3309 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 89.646 |
| InChI Key: | SGHORAFNOMICFA-UHFFFAOYSA-N |