4-{[N-(butan-2-yl)pentanamido]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
4-{[N-(butan-2-yl)pentanamido]methyl}phenyl ethanesulfonate
4-{[N-(butan-2-yl)pentanamido]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V006-8186 |
| Compound Name: | 4-{[N-(butan-2-yl)pentanamido]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 355.5 |
| Molecular Formula: | C18 H29 N O4 S |
| Smiles: | CCCCC(N(Cc1ccc(cc1)OS(CC)(=O)=O)C(C)CC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6717 |
| logD: | 3.6717 |
| logSw: | -3.6582 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.631 |
| InChI Key: | YZLUICDNTSYHBM-HNNXBMFYSA-N |