[1-(2H-1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl](4-nitrophenyl)methanone
Chemical Structure Depiction of
[1-(2H-1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl](4-nitrophenyl)methanone
[1-(2H-1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl](4-nitrophenyl)methanone
Compound characteristics
| Compound ID: | 8009-4832 |
| Compound Name: | [1-(2H-1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl](4-nitrophenyl)methanone |
| Molecular Weight: | 441.44 |
| Molecular Formula: | C25 H19 N3 O5 |
| Smiles: | C1CN(C(c2ccc3c(c2)OCO3)c2c1c1ccccc1[nH]2)C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9631 |
| logD: | 4.9631 |
| logSw: | -5.1885 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.568 |
| InChI Key: | GYCOEWBCAZVTOA-XMMPIXPASA-N |