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145775-14-0 | L-Methionine, N-[2-(mercaptomethyl)-3-(2-methylphenyl)-1-oxopropyl]-
CAS No: 145775-14-0 Catalog No: AG001DEJ MDL No:
Product Description
Catalog Number:
AG001DEJ
Chemical Name:
L-Methionine, N-[2-(mercaptomethyl)-3-(2-methylphenyl)-1-oxopropyl]-
CAS Number:
145775-14-0
Molecular Formula:
C16H23NO3S2
Molecular Weight:
341.4887
IUPAC Name:
2-[[2-[(2-methylphenyl)methyl]-3-sulfanylpropanoyl]amino]-4-methylsulfanylbutanoic acid
InChI:
InChI=1S/C16H23NO3S2/c1-11-5-3-4-6-12(11)9-13(10-21)15(18)17-14(16(19)20)7-8-22-2/h3-6,13-14,21H,7-10H2,1-2H3,(H,17,18)(H,19,20)
InChI Key:
FGXXIAHRYGHABD-UHFFFAOYSA-N
SMILES:
CSCC[C@@H](C(=O)O)NC(=O)C(Cc1ccccc1C)CS
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.112g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
341.484g/mol
Monoisotopic Mass:
341.112g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
92.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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