3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid
3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-0583 |
| Compound Name: | 3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 402.54 |
| Molecular Formula: | C26 H30 N2 O2 |
| Smiles: | Cc1ccccc1Cn1c(C(O)=O)c(CNCCC2CCCCC=2)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 5.1499 |
| logD: | 5.1499 |
| logSw: | -4.7893 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.676 |
| InChI Key: | BRSNSZVTEKQXNP-UHFFFAOYSA-N |