3-{[(2-methoxyethyl)(4-methylbenzene-1-sulfonyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-{[(2-methoxyethyl)(4-methylbenzene-1-sulfonyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
3-{[(2-methoxyethyl)(4-methylbenzene-1-sulfonyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V011-8594 |
| Compound Name: | 3-{[(2-methoxyethyl)(4-methylbenzene-1-sulfonyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 493.57 |
| Molecular Formula: | C23 H24 F N O6 S2 |
| Smiles: | Cc1ccc(cc1)S(N(CCOC)Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4521 |
| logD: | 4.4521 |
| logSw: | -4.3491 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 75.696 |
| InChI Key: | ZXMCMEYKNBTUMK-UHFFFAOYSA-N |