1-[(2-chloro-4-fluorophenyl)methyl]-3-({[1-(ethoxycarbonyl)piperidin-4-yl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3-({[1-(ethoxycarbonyl)piperidin-4-yl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(2-chloro-4-fluorophenyl)methyl]-3-({[1-(ethoxycarbonyl)piperidin-4-yl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-2616 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3-({[1-(ethoxycarbonyl)piperidin-4-yl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 487.96 |
| Molecular Formula: | C25 H27 Cl F N3 O4 |
| Smiles: | CCOC(N1CCC(CC1)NCc1c2ccccc2n(Cc2ccc(cc2[Cl])F)c1C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4009 |
| logD: | 4.4009 |
| logSw: | -4.3352 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.939 |
| InChI Key: | CUBKWRIIMRRXFP-UHFFFAOYSA-N |