but-2-en-1-yl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Chemical Structure Depiction of
but-2-en-1-yl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
but-2-en-1-yl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Compound characteristics
Compound ID: | C276-0634 |
Compound Name: | but-2-en-1-yl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate |
Molecular Weight: | 323.39 |
Molecular Formula: | C20 H21 N O3 |
Smiles: | C/C=C/COC(c1c(C)c2C(CC(Cc2[nH]1)c1ccccc1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.0621 |
logD: | 4.0621 |
logSw: | -4.352 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.089 |
InChI Key: | WJBMRHSXFAMPLP-OAHLLOKOSA-N |