5-[3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1H-indol-1-yl]thiophene-2-carboxylic acid
Chemical Structure Depiction of
5-[3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1H-indol-1-yl]thiophene-2-carboxylic acid
5-[3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1H-indol-1-yl]thiophene-2-carboxylic acid
Compound characteristics
| Compound ID: | G381-0233 |
| Compound Name: | 5-[3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1H-indol-1-yl]thiophene-2-carboxylic acid |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C23 H22 N2 O4 S |
| Smiles: | COc1ccc(c(CNCc2cn(c3ccccc23)c2ccc(C(O)=O)s2)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.6003 |
| logD: | 4.6003 |
| logSw: | -4.1909 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.148 |
| InChI Key: | PXJJWAURTHYNMT-UHFFFAOYSA-N |