4-{[2-(6-chloro-1H-indol-1-yl)acetamido]methyl}cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
4-{[2-(6-chloro-1H-indol-1-yl)acetamido]methyl}cyclohexane-1-carboxylic acid
4-{[2-(6-chloro-1H-indol-1-yl)acetamido]methyl}cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y044-1141 |
| Compound Name: | 4-{[2-(6-chloro-1H-indol-1-yl)acetamido]methyl}cyclohexane-1-carboxylic acid |
| Molecular Weight: | 348.83 |
| Molecular Formula: | C18 H21 Cl N2 O3 |
| Smiles: | C1C[C@@H](CC[C@H]1CNC(Cn1ccc2ccc(cc12)[Cl])=O)C(O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9438 |
| logD: | 0.3835 |
| logSw: | -3.2834 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.149 |
| InChI Key: | KBKDTIRPSSFLPI-UHFFFAOYSA-N |