4-({3-cyclopentyl-N-[(furan-2-yl)methyl]propanamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
4-({3-cyclopentyl-N-[(furan-2-yl)methyl]propanamido}methyl)phenyl methanesulfonate
4-({3-cyclopentyl-N-[(furan-2-yl)methyl]propanamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V012-1534 |
| Compound Name: | 4-({3-cyclopentyl-N-[(furan-2-yl)methyl]propanamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 405.51 |
| Molecular Formula: | C21 H27 N O5 S |
| Smiles: | CS(=O)(=O)Oc1ccc(CN(Cc2ccco2)C(CCC2CCCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5008 |
| logD: | 3.5008 |
| logSw: | -3.8697 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.106 |
| InChI Key: | RKCBCFMPGAXHKG-UHFFFAOYSA-N |