(2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)(4-nitrophenyl)methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
(2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)(4-nitrophenyl)methanone--hydrogen chloride (1/1)
(2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)(4-nitrophenyl)methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8009-4316 |
| Compound Name: | (2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)(4-nitrophenyl)methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 387.86 |
| Molecular Formula: | C20 H21 N3 O3 |
| Salt: | HCl |
| Smiles: | Cc1ccc2c(c1)C1CN(C)CCC1N2C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5859 |
| logD: | 0.963 |
| logSw: | -3.1048 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.573 |
| InChI Key: | QYHGDUIFCYJAES-UHFFFAOYSA-N |