1-benzyl-3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-6-methoxy-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-benzyl-3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-6-methoxy-1H-indole-2-carboxylic acid
1-benzyl-3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-6-methoxy-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-1044 |
| Compound Name: | 1-benzyl-3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-6-methoxy-1H-indole-2-carboxylic acid |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C26 H30 N2 O3 |
| Smiles: | COc1ccc2c(CNCCC3CCCCC=3)c(C(O)=O)n(Cc3ccccc3)c2c1 |
| Stereo: | ACHIRAL |
| logP: | 4.486 |
| logD: | 4.486 |
| logSw: | -4.4732 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.22 |
| InChI Key: | FPOXEAIMLMVSGE-UHFFFAOYSA-N |