N-(Chloroacetyl)-N-(4-methylbenzene-1-sulfonyl)phenylalanine
2-[(2-chloroacetyl)-(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid
Also Known As: AC1Q3TBB|AC1L1R6E|Tosyl-L-phenylalanylchloromethyl ketone|N-Tosyl-L-phenylalanine chloromethyl ketone|N-(Chloroacetyl)-3-phenyl-N-(p-tolylsulfonyl)alanine|ALANINE, N-(CHLOROACETYL)-3-PHENYL-N-(p-TOLYLSULFONYL)-|n-(chloroacetyl)-n-[(4-methylphenyl)sulfonyl]phenylalanine|N-(Chloroacetyl)-N-((4-methylphenyl)sulfonyl)-L-phenylalanine|N-(Chloroacetyl)-N-(4-methylbenzene-1-sulfonyl)phenylalanine|2-[(2-chloroacetyl)-(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid
| Molecular Formula | C18H18ClNO5S |
|---|---|
| Molecular Weight | 395.05942 g/mol |
| LogP | 2.45 |
| Topological Polar Surface Area | 91.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 395.05942 |
| Heavy Atoms | 26 |
| Complexity | 881.6 |
Chemical Identifiers
| CAS Number | 102516-65-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(C(CC2=CC=CC=C2)C(=O)O)C(=O)CCl |
Product Overview
N-(Chloroacetyl)-N-(4-methylbenzene-1-sulfonyl)phenylalanine (CAS 102516-65-4), with molecular formula C18H18ClNO5S and molecular weight 395.05942 g/mol. IUPAC: 2-[(2-chloroacetyl)-(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid.
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