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Home > Nitro Compounds > 605628-06-6
605628-06-6 | Piperidine, 4-(2-benzothiazolyl)-1-(4-nitrobenzoyl)- (9CI)
CAS No: 605628-06-6 Catalog No: AG00F81N MDL No:
Product Description
Catalog Number:
AG00F81N
Chemical Name:
Piperidine, 4-(2-benzothiazolyl)-1-(4-nitrobenzoyl)- (9CI)
CAS Number:
605628-06-6
IUPAC Name:
[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(4-nitrophenyl)methanone
InChI:
InChI=1S/C19H17N3O3S/c23-19(14-5-7-15(8-6-14)22(24)25)21-11-9-13(10-12-21)18-20-16-3-1-2-4-17(16)26-18/h1-8,13H,9-12H2
InChI Key:
LKUPLVZMWOTDQX-UHFFFAOYSA-N
Properties
Complexity:
525
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.099g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
367.423g/mol
Monoisotopic Mass:
367.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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