5-chloro-3-[2-({3-[ethyl(phenyl)amino]propyl}amino)-2-oxoethyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
5-chloro-3-[2-({3-[ethyl(phenyl)amino]propyl}amino)-2-oxoethyl]-1H-indole-2-carboxylic acid
5-chloro-3-[2-({3-[ethyl(phenyl)amino]propyl}amino)-2-oxoethyl]-1H-indole-2-carboxylic acid
Compound characteristics
Compound ID: | C289-0355 |
Compound Name: | 5-chloro-3-[2-({3-[ethyl(phenyl)amino]propyl}amino)-2-oxoethyl]-1H-indole-2-carboxylic acid |
Molecular Weight: | 413.9 |
Molecular Formula: | C22 H24 Cl N3 O3 |
Smiles: | CCN(CCCNC(Cc1c2cc(ccc2[nH]c1C(O)=O)[Cl])=O)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 3.2941 |
logD: | 0.7396 |
logSw: | -3.5364 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 65.797 |
InChI Key: | ZGWIPGHEDMMTGF-UHFFFAOYSA-N |