N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N'-(1,2,3,4-tetrahydronaphthalen-1-yl)thiourea
Chemical Structure Depiction of
N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N'-(1,2,3,4-tetrahydronaphthalen-1-yl)thiourea
N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N'-(1,2,3,4-tetrahydronaphthalen-1-yl)thiourea
Compound characteristics
| Compound ID: | C066-3456 |
| Compound Name: | N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N'-(1,2,3,4-tetrahydronaphthalen-1-yl)thiourea |
| Molecular Weight: | 418.56 |
| Molecular Formula: | C24 H26 N4 O S |
| Smiles: | C1CCC2=Nc3ccc(cc3C(N2CC1)=O)NC(NC1CCCc2ccccc12)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3076 |
| logD: | 4.3076 |
| logSw: | -4.2329 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.708 |
| InChI Key: | FXDDVNKSGKOBNO-FQEVSTJZSA-N |