1-[(4-chlorophenyl)methyl]-3-{[(propan-2-yl)amino]methyl}-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-3-{[(propan-2-yl)amino]methyl}-1H-indole-2-carboxylic acid
1-[(4-chlorophenyl)methyl]-3-{[(propan-2-yl)amino]methyl}-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-2228 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-3-{[(propan-2-yl)amino]methyl}-1H-indole-2-carboxylic acid |
| Molecular Weight: | 356.85 |
| Molecular Formula: | C20 H21 Cl N2 O2 |
| Smiles: | CC(C)NCc1c2ccccc2n(Cc2ccc(cc2)[Cl])c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9981 |
| logD: | 3.9981 |
| logSw: | -4.3278 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.679 |
| InChI Key: | HKQNQGMXVFRLGT-UHFFFAOYSA-N |