3-({[2,6-di(propan-2-yl)phenyl]-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
3-({[2,6-di(propan-2-yl)phenyl]-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
3-({[2,6-di(propan-2-yl)phenyl]-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V001-4146 |
| Compound Name: | 3-({[2,6-di(propan-2-yl)phenyl]-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 484.61 |
| Molecular Formula: | C26 H32 N2 O5 S |
| Smiles: | CC(C)c1cccc(C(C)C)c1NC(N(Cc1cccc(c1)OS(C)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3138 |
| logD: | 4.3138 |
| logSw: | -4.2673 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.501 |
| InChI Key: | QNECZNZXNAUZRZ-UHFFFAOYSA-N |