|A-Sulfocaprinsaeure
2-[butan-2-yl-[(2,4-dimethylphenyl)carbamoyl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-(thiophen-2-ylmethyl)acetamide
Also Known As: |A-Sulfocaprinsaeure|2-Sulfo-decanoic acid|2-[butan-2-yl-[(2,4-dimethylphenyl)carbamoyl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-(thiophen-2-ylmethyl)acetamide|N-(Butan-2-yl)-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-N'-(2,4-dimethylphenyl)carbamimidic acid|N-Butan-2-yl-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-N'-(2,4-dimethylphenyl)carbamimidic acid
| Molecular Formula | C30H39N3O4S |
|---|---|
| Molecular Weight | 537.2661 g/mol |
| LogP | 6.28604 |
| Topological Polar Surface Area | 71.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 537.2661 |
| Monoisotopic Mass | 537.2661 |
| Heavy Atoms | 38 |
| Complexity | 1212.2119 |
Chemical Identifiers
| CAS Number | 5917-52-2 |
|---|---|
| SMILES | CCC(C)N(CC(=O)N(CCC1=CC(=C(C=C1)OC)OC)CC2=CC=CS2)C(=O)NC3=C(C=C(C=C3)C)C |
Product Overview
|A-Sulfocaprinsaeure (CAS 5917-52-2), with molecular formula C30H39N3O4S and molecular weight 537.2661 g/mol. IUPAC: 2-[butan-2-yl-[(2,4-dimethylphenyl)carbamoyl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-(thiophen-2-ylmethyl)acetamide.
|A-Sulfocaprinsaeure is a custom synthesis product. We offer services from milligram to kilogram scale.
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