3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
Compound characteristics
Compound ID: | E518-0611 |
Compound Name: | 3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid |
Molecular Weight: | 436.53 |
Molecular Formula: | C26 H29 F N2 O3 |
Smiles: | COc1ccc2c(CNCCC3CCCCC=3)c(C(O)=O)n(Cc3ccccc3F)c2c1 |
Stereo: | ACHIRAL |
logP: | 4.764 |
logD: | 4.764 |
logSw: | -4.561 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 48.22 |
InChI Key: | PULPXBFFMRLJQW-UHFFFAOYSA-N |