1-[(4-methoxyphenyl)methyl]-2,5-dimethyl-4-({[3-(propylsulfanyl)propyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-[(4-methoxyphenyl)methyl]-2,5-dimethyl-4-({[3-(propylsulfanyl)propyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
1-[(4-methoxyphenyl)methyl]-2,5-dimethyl-4-({[3-(propylsulfanyl)propyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G396-1227 |
| Compound Name: | 1-[(4-methoxyphenyl)methyl]-2,5-dimethyl-4-({[3-(propylsulfanyl)propyl]amino}methyl)-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 404.57 |
| Molecular Formula: | C22 H32 N2 O3 S |
| Smiles: | CCCSCCCNCc1c(C(O)=O)c(C)n(Cc2ccc(cc2)OC)c1C |
| Stereo: | ACHIRAL |
| logP: | 3.3407 |
| logD: | 3.3407 |
| logSw: | -3.4881 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.767 |
| InChI Key: | UVJDUOYMVHWQBP-UHFFFAOYSA-N |