5-amino-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C368-0261 |
| Compound Name: | 5-amino-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 440.46 |
| Molecular Formula: | C21 H24 N6 O5 |
| Smiles: | COc1ccc(c(c1)OC)NC(Cn1c(c(C(NCc2ccccc2OC)=O)nn1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2465 |
| logD: | 1.2464 |
| logSw: | -2.2775 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 115.866 |
| InChI Key: | HXMRKPSBWCMXNS-UHFFFAOYSA-N |