5-(diethylamino)-2-({N-[(furan-2-yl)methyl]-3-methylbutanamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-({N-[(furan-2-yl)methyl]-3-methylbutanamido}methyl)phenyl methanesulfonate
5-(diethylamino)-2-({N-[(furan-2-yl)methyl]-3-methylbutanamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V001-5783 |
| Compound Name: | 5-(diethylamino)-2-({N-[(furan-2-yl)methyl]-3-methylbutanamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 436.57 |
| Molecular Formula: | C22 H32 N2 O5 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(Cc2ccco2)C(CC(C)C)=O)c(c1)OS(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9315 |
| logD: | 3.9219 |
| logSw: | -3.8917 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.643 |
| InChI Key: | BORCIPYHQCUHDN-UHFFFAOYSA-N |