3,4,5-triethoxy-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)benzamide
Chemical Structure Depiction of
3,4,5-triethoxy-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)benzamide
3,4,5-triethoxy-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)benzamide
Compound characteristics
| Compound ID: | C803-0339 |
| Compound Name: | 3,4,5-triethoxy-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)benzamide |
| Molecular Weight: | 465.55 |
| Molecular Formula: | C26 H31 N3 O5 |
| Smiles: | CCOc1cc(cc(c1OCC)OCC)C(Nc1ccc2c(c1)C(N1CCCCCC1=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6809 |
| logD: | 3.6808 |
| logSw: | -3.8952 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.528 |
| InChI Key: | ULWJTTIBIGWPPB-UHFFFAOYSA-N |