6',6'-dimethyl-2'',3'',4'',5',6',9''-hexahydro-2'H-dispiro[cyclohexane-1,4'-pyrrolo[3,2,1-ij]quinoline-1',1''-pyrido[3,4-b]indol]-2'-one
Chemical Structure Depiction of
6',6'-dimethyl-2'',3'',4'',5',6',9''-hexahydro-2'H-dispiro[cyclohexane-1,4'-pyrrolo[3,2,1-ij]quinoline-1',1''-pyrido[3,4-b]indol]-2'-one
6',6'-dimethyl-2'',3'',4'',5',6',9''-hexahydro-2'H-dispiro[cyclohexane-1,4'-pyrrolo[3,2,1-ij]quinoline-1',1''-pyrido[3,4-b]indol]-2'-one
Compound characteristics
| Compound ID: | Y020-7836 |
| Compound Name: | 6',6'-dimethyl-2'',3'',4'',5',6',9''-hexahydro-2'H-dispiro[cyclohexane-1,4'-pyrrolo[3,2,1-ij]quinoline-1',1''-pyrido[3,4-b]indol]-2'-one |
| Molecular Weight: | 425.57 |
| Molecular Formula: | C28 H31 N3 O |
| Smiles: | CC1(C)CC2(CCCCC2)N2C(C3(c4cccc1c24)c1c(CCN3)c2ccccc2[nH]1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1157 |
| logD: | 0.2446 |
| logSw: | -5.0673 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.508 |
| InChI Key: | JFCNLEUEUKFFGN-NDEPHWFRSA-N |