2-{[N-(butan-2-yl)-3-methylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-{[N-(butan-2-yl)-3-methylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
2-{[N-(butan-2-yl)-3-methylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-4719 |
| Compound Name: | 2-{[N-(butan-2-yl)-3-methylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 433.57 |
| Molecular Formula: | C23 H31 N O5 S |
| Smiles: | CCC(C)N(Cc1ccccc1OS(c1ccc(cc1)OC)(=O)=O)C(CC(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1685 |
| logD: | 5.1685 |
| logSw: | -5.0015 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.914 |
| InChI Key: | YXJIQEZERFOYNP-SFHVURJKSA-N |