1-[(2,5-dimethylphenyl)methyl]-3-({[(thiophen-2-yl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2,5-dimethylphenyl)methyl]-3-({[(thiophen-2-yl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(2,5-dimethylphenyl)methyl]-3-({[(thiophen-2-yl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-0560 |
| Compound Name: | 1-[(2,5-dimethylphenyl)methyl]-3-({[(thiophen-2-yl)methyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 404.53 |
| Molecular Formula: | C24 H24 N2 O2 S |
| Smiles: | Cc1ccc(C)c(Cn2c(C(O)=O)c(CNCc3cccs3)c3ccccc23)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.1304 |
| logD: | 5.1304 |
| logSw: | -4.8595 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.661 |
| InChI Key: | ZGZSKKCQDIBQAV-UHFFFAOYSA-N |