1-[(2-chloro-4-fluorophenyl)methyl]-3-[(cyclopentylamino)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3-[(cyclopentylamino)methyl]-1H-indole-2-carboxylic acid
1-[(2-chloro-4-fluorophenyl)methyl]-3-[(cyclopentylamino)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-2626 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3-[(cyclopentylamino)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 400.88 |
| Molecular Formula: | C22 H22 Cl F N2 O2 |
| Smiles: | C1CCC(C1)NCc1c2ccccc2n(Cc2ccc(cc2[Cl])F)c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.824 |
| logD: | 4.824 |
| logSw: | -4.5316 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.525 |
| InChI Key: | NPXBCJFKWKMSQL-UHFFFAOYSA-N |