3-[(N-cyclopropyl-4-nitrobenzamido)methyl]phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-[(N-cyclopropyl-4-nitrobenzamido)methyl]phenyl 4-fluorobenzene-1-sulfonate
3-[(N-cyclopropyl-4-nitrobenzamido)methyl]phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V006-5801 |
| Compound Name: | 3-[(N-cyclopropyl-4-nitrobenzamido)methyl]phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 470.48 |
| Molecular Formula: | C23 H19 F N2 O6 S |
| Smiles: | C1CC1N(Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4685 |
| logD: | 4.4685 |
| logSw: | -4.5639 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.897 |
| InChI Key: | TZMVJGNOFJVGRP-UHFFFAOYSA-N |