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338395-72-5 | (5-{5-[(2,4-dichlorophenoxy)methyl]-1,3,4-oxadiazol-2-yl}-1-methyl-1H-pyrrol-3-yl)(2,4-dichlorophenyl)methanone
CAS No: 338395-72-5 Catalog No: AG01FOLW MDL No:
Product Description
Catalog Number:
AG01FOLW
Chemical Name:
(5-{5-[(2,4-dichlorophenoxy)methyl]-1,3,4-oxadiazol-2-yl}-1-methyl-1H-pyrrol-3-yl)(2,4-dichlorophenyl)methanone
CAS Number:
338395-72-5
IUPAC Name:
[5-[5-[(2,4-dichlorophenoxy)methyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrol-3-yl]-(2,4-dichlorophenyl)methanone
InChI:
InChI=1S/C21H13Cl4N3O3/c1-28-9-11(20(29)14-4-2-12(22)7-15(14)24)6-17(28)21-27-26-19(31-21)10-30-18-5-3-13(23)8-16(18)25/h2-9H,10H2,1H3
InChI Key:
UZTPTHLHHOUUJL-UHFFFAOYSA-N
Properties
Complexity:
633
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
496.968g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
497.153g/mol
Monoisotopic Mass:
494.971g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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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