(2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)(4-methoxy-3-nitrophenyl)methanone
Chemical Structure Depiction of
(2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)(4-methoxy-3-nitrophenyl)methanone
(2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)(4-methoxy-3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | Y205-1180 |
| Compound Name: | (2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)(4-methoxy-3-nitrophenyl)methanone |
| Molecular Weight: | 381.43 |
| Molecular Formula: | C21 H23 N3 O4 |
| Smiles: | Cc1ccc2c(c1)C1CN(C)CCC1N2C(c1ccc(c(c1)[N+]([O-])=O)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0748 |
| logD: | 0.4519 |
| logSw: | -2.9569 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.902 |
| InChI Key: | SIXSDQDRYMKEPA-UHFFFAOYSA-N |