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Home > Nitro Compounds > 140893-32-9
140893-32-9 | Pyridine, 3-[3-[(4-nitrophenyl)sulfonyl]-2-thiazolidinyl]-
CAS No: 140893-32-9 Catalog No: AG001CYL MDL No:
Product Description
Catalog Number:
AG001CYL
Chemical Name:
Pyridine, 3-[3-[(4-nitrophenyl)sulfonyl]-2-thiazolidinyl]-
CAS Number:
140893-32-9
Molecular Formula:
C14H13N3O4S2
Molecular Weight:
351.4007
IUPAC Name:
3-(4-nitrophenyl)sulfonyl-2-pyridin-3-yl-1,3-thiazolidine
InChI:
InChI=1S/C14H13N3O4S2/c18-17(19)12-3-5-13(6-4-12)23(20,21)16-8-9-22-14(16)11-2-1-7-15-10-11/h1-7,10,14H,8-9H2
InChI Key:
SBQJVIWUBBBNRM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)S(=O)(=O)N1CCSC1c1cccnc1
Properties
Complexity:
523
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.035g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
351.395g/mol
Monoisotopic Mass:
351.035g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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