2-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
2-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-7403 |
| Compound Name: | 2-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 459.54 |
| Molecular Formula: | C24 H26 F N O5 S |
| Smiles: | CC(C)(C)CC(N(Cc1ccccc1OS(c1ccc(cc1)F)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3041 |
| logD: | 5.3041 |
| logSw: | -5.3212 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.519 |
| InChI Key: | BBMNMEIFPZNNCG-UHFFFAOYSA-N |