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3257-18-9 | Z-Cys(Bzl)-OH
CAS No: 3257-18-9 Catalog No: AG003SVT MDL No:MFCD00004785
Product Description
Catalog Number:
AG003SVT
Chemical Name:
Z-Cys(Bzl)-OH
CAS Number:
3257-18-9
Molecular Formula:
C18H19NO4S
Molecular Weight:
345.4128
MDL Number:
MFCD00004785
IUPAC Name:
(2R)-3-benzylsulfanyl-2-(phenylmethoxycarbonylamino)propanoic acid
InChI:
InChI=1S/C18H19NO4S/c20-17(21)16(13-24-12-15-9-5-2-6-10-15)19-18(22)23-11-14-7-3-1-4-8-14/h1-10,16H,11-13H2,(H,19,22)(H,20,21)/t16-/m0/s1
InChI Key:
ATPNWHGYKFXQNF-INIZCTEOSA-N
SMILES:
O=C(N[C@H](C(=O)O)CSCc1ccccc1)OCc1ccccc1
EC Number:
221-855-8
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
345.103g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
345.413g/mol
Monoisotopic Mass:
345.103g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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