5-(3-{[(3-methylbutyl)amino]methyl}-1H-indol-1-yl)thiophene-2-carboxylic acid
Chemical Structure Depiction of
5-(3-{[(3-methylbutyl)amino]methyl}-1H-indol-1-yl)thiophene-2-carboxylic acid
5-(3-{[(3-methylbutyl)amino]methyl}-1H-indol-1-yl)thiophene-2-carboxylic acid
Compound characteristics
| Compound ID: | G381-0088 |
| Compound Name: | 5-(3-{[(3-methylbutyl)amino]methyl}-1H-indol-1-yl)thiophene-2-carboxylic acid |
| Molecular Weight: | 342.46 |
| Molecular Formula: | C19 H22 N2 O2 S |
| Smiles: | CC(C)CCNCc1cn(c2ccccc12)c1ccc(C(O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.2365 |
| logD: | 4.2365 |
| logSw: | -3.8511 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.086 |
| InChI Key: | VGIKQSNNJSRQQN-UHFFFAOYSA-N |