N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N'-[(oxolan-2-yl)methyl]thiourea
Chemical Structure Depiction of
N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N'-[(oxolan-2-yl)methyl]thiourea
N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N'-[(oxolan-2-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C066-3542 |
| Compound Name: | N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N'-[(oxolan-2-yl)methyl]thiourea |
| Molecular Weight: | 372.49 |
| Molecular Formula: | C19 H24 N4 O2 S |
| Smiles: | C1CCC2=Nc3ccc(cc3C(N2CC1)=O)NC(NCC1CCCO1)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9178 |
| logD: | 1.9177 |
| logSw: | -2.8771 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.519 |
| InChI Key: | DAWCPGMWGSVNIW-CQSZACIVSA-N |