butan-2-yl 4-(9-ethyl-9H-carbazol-3-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
butan-2-yl 4-(9-ethyl-9H-carbazol-3-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
butan-2-yl 4-(9-ethyl-9H-carbazol-3-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
Compound ID: | 3404-5406 |
Compound Name: | butan-2-yl 4-(9-ethyl-9H-carbazol-3-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
Molecular Weight: | 484.64 |
Molecular Formula: | C31 H36 N2 O3 |
Smiles: | CCC(C)OC(C1C(C2=C(CC(C)(C)CC2=O)NC=1C)c1ccc2c(c1)c1ccccc1n2CC)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 7.3069 |
logD: | 3.0197 |
logSw: | -5.8723 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 44.937 |
InChI Key: | SXTMYIHRXFYEHJ-UHFFFAOYSA-N |