5-{[N-(butan-2-yl)-3-methylbutanamido]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
5-{[N-(butan-2-yl)-3-methylbutanamido]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
5-{[N-(butan-2-yl)-3-methylbutanamido]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-6723 |
| Compound Name: | 5-{[N-(butan-2-yl)-3-methylbutanamido]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 451.56 |
| Molecular Formula: | C23 H30 F N O5 S |
| Smiles: | CCC(C)N(Cc1ccc(c(c1)OS(c1ccc(cc1)F)(=O)=O)OC)C(CC(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6658 |
| logD: | 4.6658 |
| logSw: | -4.4695 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59 |
| InChI Key: | DHZMRVFUROASCL-KRWDZBQOSA-N |