N-[3-(4-ethoxyphenyl)-1,2-oxazol-5-yl]-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-[3-(4-ethoxyphenyl)-1,2-oxazol-5-yl]-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
N-[3-(4-ethoxyphenyl)-1,2-oxazol-5-yl]-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | C849-0666 |
| Compound Name: | N-[3-(4-ethoxyphenyl)-1,2-oxazol-5-yl]-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide |
| Molecular Weight: | 444.49 |
| Molecular Formula: | C25 H24 N4 O4 |
| Smiles: | CCOc1ccc(cc1)c1cc(NC(c2ccc3C(N4CCCCCC4=Nc3c2)=O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.8753 |
| logD: | 3.8656 |
| logSw: | -3.9074 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.215 |
| InChI Key: | YHZXJAZYHKZXHC-UHFFFAOYSA-N |