1-nonyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
Chemical Structure Depiction of
1-nonyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
1-nonyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
Compound characteristics
Compound ID: | 1323-0012 |
Compound Name: | 1-nonyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid |
Molecular Weight: | 342.48 |
Molecular Formula: | C21 H30 N2 O2 |
Smiles: | CCCCCCCCCC1c2c(CC(C(O)=O)N1)c1ccccc1[nH]2 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.7741 |
logD: | 1.9663 |
logSw: | -4.5518 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 51.585 |
InChI Key: | CXNATEZOVVRARQ-UHFFFAOYSA-N |