4-({(butan-2-yl)[(thiophen-2-yl)acetyl]amino}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
4-({(butan-2-yl)[(thiophen-2-yl)acetyl]amino}methyl)phenyl ethanesulfonate
4-({(butan-2-yl)[(thiophen-2-yl)acetyl]amino}methyl)phenyl ethanesulfonate
Compound characteristics
Compound ID: | V028-5536 |
Compound Name: | 4-({(butan-2-yl)[(thiophen-2-yl)acetyl]amino}methyl)phenyl ethanesulfonate |
Molecular Weight: | 395.54 |
Molecular Formula: | C19 H25 N O4 S2 |
Smiles: | CCC(C)N(Cc1ccc(cc1)OS(CC)(=O)=O)C(Cc1cccs1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3642 |
logD: | 3.3642 |
logSw: | -3.5057 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 51.377 |
InChI Key: | HZFANKUOBWBCHG-HNNXBMFYSA-N |