2-(1H-benzotriazol-1-yl)-N-[1-(2,3-dimethoxyphenyl)-2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl]-N-[(4-methoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-(1H-benzotriazol-1-yl)-N-[1-(2,3-dimethoxyphenyl)-2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl]-N-[(4-methoxyphenyl)methyl]acetamide
2-(1H-benzotriazol-1-yl)-N-[1-(2,3-dimethoxyphenyl)-2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl]-N-[(4-methoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | D092-0129 |
| Compound Name: | 2-(1H-benzotriazol-1-yl)-N-[1-(2,3-dimethoxyphenyl)-2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl]-N-[(4-methoxyphenyl)methyl]acetamide |
| Molecular Weight: | 573.65 |
| Molecular Formula: | C31 H35 N5 O6 |
| Smiles: | COc1ccc(CN(C(C(NCC2CCCO2)=O)c2cccc(c2OC)OC)C(Cn2c3ccccc3nn2)=O)cc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6245 |
| logD: | 2.6245 |
| logSw: | -2.9985 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.291 |
| InChI Key: | JAFMUIBZDIRNAZ-UHFFFAOYSA-N |