3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-7,8,9,10-tetrahydroazepino[2,1-b]quinazolin-12(6H)-one
Chemical Structure Depiction of
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-7,8,9,10-tetrahydroazepino[2,1-b]quinazolin-12(6H)-one
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-7,8,9,10-tetrahydroazepino[2,1-b]quinazolin-12(6H)-one
Compound characteristics
| Compound ID: | C849-0586 |
| Compound Name: | 3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-7,8,9,10-tetrahydroazepino[2,1-b]quinazolin-12(6H)-one |
| Molecular Weight: | 373.45 |
| Molecular Formula: | C23 H23 N3 O2 |
| Smiles: | C1CCC2=Nc3cc(ccc3C(N2CC1)=O)C(N1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6482 |
| logD: | 2.6481 |
| logSw: | -3.2627 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.03 |
| InChI Key: | OYSWISCKAAQGOZ-UHFFFAOYSA-N |