3-({N-[(furan-2-yl)methyl](3-methoxyphenyl)carbamamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
3-({N-[(furan-2-yl)methyl](3-methoxyphenyl)carbamamido}methyl)phenyl methanesulfonate
3-({N-[(furan-2-yl)methyl](3-methoxyphenyl)carbamamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V012-1526 |
| Compound Name: | 3-({N-[(furan-2-yl)methyl](3-methoxyphenyl)carbamamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 430.48 |
| Molecular Formula: | C21 H22 N2 O6 S |
| Smiles: | COc1cccc(c1)NC(N(Cc1cccc(c1)OS(C)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3981 |
| logD: | 3.3981 |
| logSw: | -3.904 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.44 |
| InChI Key: | NKBDDQRXVHLKSA-UHFFFAOYSA-N |