4-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-2,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
4-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-2,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
4-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-2,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C879-0526 |
| Compound Name: | 4-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-2,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 380.53 |
| Molecular Formula: | C24 H32 N2 O2 |
| Smiles: | Cc1ccccc1Cn1c(C)c(CNCCC2CCCCC=2)c(C(O)=O)c1C |
| Stereo: | ACHIRAL |
| logP: | 4.5674 |
| logD: | 4.5674 |
| logSw: | -4.2404 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.144 |
| InChI Key: | YIMFQAWEDOYZNC-UHFFFAOYSA-N |