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875901-35-2 | L-Leucine, N-[[4-(2-chlorophenoxy)phenyl]sulfonyl]-
CAS No: 875901-35-2 Catalog No: AG01FN3P MDL No:MFCD03619096
Product Description
Catalog Number:
AG01FN3P
Chemical Name:
L-Leucine, N-[[4-(2-chlorophenoxy)phenyl]sulfonyl]-
CAS Number:
875901-35-2
Molecular Formula:
C18H20ClNO5S
Molecular Weight:
397.8731
MDL Number:
MFCD03619096
IUPAC Name:
2-[[4-(2-chlorophenoxy)phenyl]sulfonylamino]-4-methylpentanoic acid
InChI:
InChI=1S/C18H20ClNO5S/c1-12(2)11-16(18(21)22)20-26(23,24)14-9-7-13(8-10-14)25-17-6-4-3-5-15(17)19/h3-10,12,16,20H,11H2,1-2H3,(H,21,22)
InChI Key:
NOOHVTMKDANSCX-UHFFFAOYSA-N
SMILES:
CC(CC(C(=O)O)NS(=O)(=O)c1ccc(cc1)Oc1ccccc1Cl)C
Properties
Complexity:
554
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
397.075g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
397.87g/mol
Monoisotopic Mass:
397.075g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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