1-[(3-chlorophenyl)methyl]-2,5-dimethyl-4-{[(1,2,3,4-tetrahydronaphthalen-1-yl)amino]methyl}-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-[(3-chlorophenyl)methyl]-2,5-dimethyl-4-{[(1,2,3,4-tetrahydronaphthalen-1-yl)amino]methyl}-1H-pyrrole-3-carboxylic acid
1-[(3-chlorophenyl)methyl]-2,5-dimethyl-4-{[(1,2,3,4-tetrahydronaphthalen-1-yl)amino]methyl}-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G396-0704 |
| Compound Name: | 1-[(3-chlorophenyl)methyl]-2,5-dimethyl-4-{[(1,2,3,4-tetrahydronaphthalen-1-yl)amino]methyl}-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 422.95 |
| Molecular Formula: | C25 H27 Cl N2 O2 |
| Smiles: | Cc1c(CNC2CCCc3ccccc23)c(C(O)=O)c(C)n1Cc1cccc(c1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0902 |
| logD: | 5.0902 |
| logSw: | -5.033 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.744 |
| InChI Key: | IPUAUVDSFNQYNG-QHCPKHFHSA-N |