3-({N-[2-(dimethylamino)ethyl]-3,3-dimethylbutanamido}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
3-({N-[2-(dimethylamino)ethyl]-3,3-dimethylbutanamido}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
3-({N-[2-(dimethylamino)ethyl]-3,3-dimethylbutanamido}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-9257 |
| Compound Name: | 3-({N-[2-(dimethylamino)ethyl]-3,3-dimethylbutanamido}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 480.6 |
| Molecular Formula: | C24 H33 F N2 O5 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(N(CCN(C)C)Cc1cccc(c1)OS(c1ccc(c(c1)F)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0903 |
| logD: | 3.2015 |
| logSw: | -4.372 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.43 |
| InChI Key: | MUESEYZXLQJGJA-UHFFFAOYSA-N |