3-({N-[(furan-2-yl)methyl](dimethyl)carbamamido}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
3-({N-[(furan-2-yl)methyl](dimethyl)carbamamido}methyl)phenyl ethanesulfonate
3-({N-[(furan-2-yl)methyl](dimethyl)carbamamido}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V011-2170 |
| Compound Name: | 3-({N-[(furan-2-yl)methyl](dimethyl)carbamamido}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 366.43 |
| Molecular Formula: | C17 H22 N2 O5 S |
| Smiles: | CCS(=O)(=O)Oc1cccc(CN(Cc2ccco2)C(N(C)C)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.2663 |
| logD: | 2.2663 |
| logSw: | -2.7465 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.193 |
| InChI Key: | NGTVJLJMNDXGBY-UHFFFAOYSA-N |