1-[(2-chloro-4-fluorophenyl)methyl]-3-[({3-[(propan-2-yl)oxy]propyl}amino)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3-[({3-[(propan-2-yl)oxy]propyl}amino)methyl]-1H-indole-2-carboxylic acid
1-[(2-chloro-4-fluorophenyl)methyl]-3-[({3-[(propan-2-yl)oxy]propyl}amino)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-2663 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3-[({3-[(propan-2-yl)oxy]propyl}amino)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 432.92 |
| Molecular Formula: | C23 H26 Cl F N2 O3 |
| Smiles: | CC(C)OCCCNCc1c2ccccc2n(Cc2ccc(cc2[Cl])F)c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0614 |
| logD: | 4.0614 |
| logSw: | -4.1256 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.957 |
| InChI Key: | XMKAWTVTNSNKJM-UHFFFAOYSA-N |