1-(2-chloro-5-nitrophenyl)-6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-(2-chloro-5-nitrophenyl)-6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole--hydrogen chloride (1/1)
1-(2-chloro-5-nitrophenyl)-6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8017-8681 |
| Compound Name: | 1-(2-chloro-5-nitrophenyl)-6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole--hydrogen chloride (1/1) |
| Molecular Weight: | 394.26 |
| Molecular Formula: | C18 H16 Cl N3 O3 |
| Salt: | HCl |
| Smiles: | COc1ccc2c(c1)c1CCNC(c3cc(ccc3[Cl])[N+]([O-])=O)c1[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.661 |
| logD: | 3.6071 |
| logSw: | -4.0799 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.294 |
| InChI Key: | RELZHFFZZUGYBJ-QGZVFWFLSA-N |