4-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(2,5-dimethylphenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
4-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(2,5-dimethylphenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
4-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(2,5-dimethylphenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C879-1410 |
| Compound Name: | 4-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(2,5-dimethylphenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 394.56 |
| Molecular Formula: | C25 H34 N2 O2 |
| Smiles: | Cc1ccc(C)c(Cn2c(C)c(CNCCC3CCCCC=3)c(C(O)=O)c2C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.9948 |
| logD: | 4.9948 |
| logSw: | -4.4188 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.144 |
| InChI Key: | NDVASWNESQCNMX-UHFFFAOYSA-N |