5-ethyl-4-[(pyrrolidin-1-yl)methyl]furan-2-carboxylic acid--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-ethyl-4-[(pyrrolidin-1-yl)methyl]furan-2-carboxylic acid--hydrogen chloride (1/1)
5-ethyl-4-[(pyrrolidin-1-yl)methyl]furan-2-carboxylic acid--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8016-5756 |
| Compound Name: | 5-ethyl-4-[(pyrrolidin-1-yl)methyl]furan-2-carboxylic acid--hydrogen chloride (1/1) |
| Molecular Weight: | 259.73 |
| Molecular Formula: | C12 H17 N O3 |
| Salt: | HCl |
| Smiles: | CCc1c(CN2CCCC2)cc(C(O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 1.5703 |
| logD: | 1.5703 |
| logSw: | -1.3296 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.819 |
| InChI Key: | JFBZPQRDKOIVLF-UHFFFAOYSA-N |