1-[(2-chloro-4-fluorophenyl)methyl]-3-({[(pyridin-3-yl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3-({[(pyridin-3-yl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(2-chloro-4-fluorophenyl)methyl]-3-({[(pyridin-3-yl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-2619 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3-({[(pyridin-3-yl)methyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 423.87 |
| Molecular Formula: | C23 H19 Cl F N3 O2 |
| Smiles: | C(c1cccnc1)NCc1c2ccccc2n(Cc2ccc(cc2[Cl])F)c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8299 |
| logD: | 3.8299 |
| logSw: | -4.1488 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.16 |
| InChI Key: | QWGAQAMSJFFMTK-UHFFFAOYSA-N |