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338414-38-3 | (3E)-3-{[(4-chlorophenyl)methoxy]imino}-1-(2-phenyl-1,3-thiazol-5-yl)propan-1-one
CAS No: 338414-38-3 Catalog No: AG00IST2 MDL No:MFCD00974289
Product Description
Catalog Number:
AG00IST2
Chemical Name:
(3E)-3-{[(4-chlorophenyl)methoxy]imino}-1-(2-phenyl-1,3-thiazol-5-yl)propan-1-one
CAS Number:
338414-38-3
Molecular Formula:
C19H15ClN2O2S
Molecular Weight:
370.8526
MDL Number:
MFCD00974289
IUPAC Name:
(3E)-3-[(4-chlorophenyl)methoxyimino]-1-(2-phenyl-1,3-thiazol-5-yl)propan-1-one
InChI:
InChI=1S/C19H15ClN2O2S/c20-16-8-6-14(7-9-16)13-24-22-11-10-17(23)18-12-21-19(25-18)15-4-2-1-3-5-15/h1-9,11-12H,10,13H2/b22-11+
InChI Key:
OGRQXSHZAFVCFI-SSDVNMTOSA-N
SMILES:
Clc1ccc(cc1)CO/N=C/CC(=O)c1cnc(s1)c1ccccc1
Properties
Complexity:
449
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
370.054g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
370.851g/mol
Monoisotopic Mass:
370.054g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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