1-(5-ethyl-12-oxo-5,5a,6,7,8,9,10,12-octahydroazepino[2,1-b]quinazoline-3-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(5-ethyl-12-oxo-5,5a,6,7,8,9,10,12-octahydroazepino[2,1-b]quinazoline-3-carbonyl)piperidine-4-carboxamide
1-(5-ethyl-12-oxo-5,5a,6,7,8,9,10,12-octahydroazepino[2,1-b]quinazoline-3-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | S413-0189 |
| Compound Name: | 1-(5-ethyl-12-oxo-5,5a,6,7,8,9,10,12-octahydroazepino[2,1-b]quinazoline-3-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 398.5 |
| Molecular Formula: | C22 H30 N4 O3 |
| Smiles: | CCN1C2CCCCCN2C(c2ccc(cc12)C(N1CCC(CC1)C(N)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2486 |
| logD: | 1.2486 |
| logSw: | -2.387 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.285 |
| InChI Key: | OXUDOEIDHMALRL-IBGZPJMESA-N |