N-[(3,4-dimethoxyphenyl)methyl]-2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]acetamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]acetamide
N-[(3,4-dimethoxyphenyl)methyl]-2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]acetamide
Compound characteristics
| Compound ID: | Y043-2784 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]acetamide |
| Molecular Weight: | 437.49 |
| Molecular Formula: | C24 H27 N3 O5 |
| Smiles: | COc1ccc(CNC(COc2ccc3c(c2)C(N2CCCCCC2=N3)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.9943 |
| logD: | 1.9942 |
| logSw: | -2.7627 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.68 |
| InChI Key: | LDZZSFNIEBOZTB-UHFFFAOYSA-N |