cyanomethyl (2S)-3-(4-hydroxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanoate

CAS: 64187-18-4

Molecular Formula	`C18H18N2O5S`
Molecular Weight	374.4 g/mol
LogP	2.6
Topological Polar Surface Area	125.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	8
Exact Mass	374.09363
Heavy Atoms	26
Complexity	605.0

Chemical Identifiers

CAS Number	64187-18-4
SMILES	`CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=C(C=C2)O)C(=O)OCC#N`
InChIKey	`IRMUFNWOEHJWCP-KRWDZBQOSA-N`

📖 Product Overview

cyanomethyl (2S)-3-(4-hydroxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanoate (CAS: 64187-18-4) is a chemical compound with molecular formula C18H18N2O5S and molecular weight 374.4 g/mol. Its IUPAC systematic name is cyanomethyl (2S)-3-(4-hydroxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanoate. LogP 2.6 Topological Polar Surface Area 125.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 7 Rotatable Bonds 8 Exact Mass 374.09363 Heavy Atoms 26 Complexity 605.0 InChI Key: IRMUFNWOEHJWCP-KRWDZBQOSA-N. SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=C(C=C2)O)C(=O)OCC#N.

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