4-({N-[(furan-2-yl)methyl][4-(propan-2-yl)phenyl]carbamamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
4-({N-[(furan-2-yl)methyl][4-(propan-2-yl)phenyl]carbamamido}methyl)phenyl methanesulfonate
4-({N-[(furan-2-yl)methyl][4-(propan-2-yl)phenyl]carbamamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V011-5945 |
| Compound Name: | 4-({N-[(furan-2-yl)methyl][4-(propan-2-yl)phenyl]carbamamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 442.53 |
| Molecular Formula: | C23 H26 N2 O5 S |
| Smiles: | CC(C)c1ccc(cc1)NC(N(Cc1ccc(cc1)OS(C)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6279 |
| logD: | 4.6279 |
| logSw: | -4.2329 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.896 |
| InChI Key: | DHZSXNLAVTUVGV-UHFFFAOYSA-N |