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Home > Nitro Compounds > 313365-83-2
313365-83-2 | 4-Nitro-N-(4-thiophen-2-yl-thiazol-2-yl)-benzamide
CAS No: 313365-83-2 Catalog No: AG01F2PY MDL No:MFCD00791812
Product Description
Catalog Number:
AG01F2PY
Chemical Name:
4-Nitro-N-(4-thiophen-2-yl-thiazol-2-yl)-benzamide
CAS Number:
313365-83-2
Molecular Formula:
C14H9N3O3S2
Molecular Weight:
331.3696
MDL Number:
MFCD00791812
IUPAC Name:
4-nitro-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)benzamide
InChI:
InChI=1S/C14H9N3O3S2/c18-13(9-3-5-10(6-4-9)17(19)20)16-14-15-11(8-22-14)12-2-1-7-21-12/h1-8H,(H,15,16,18)
InChI Key:
JQQDXBXQCLURCE-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)[N+](=O)[O-])Nc1scc(n1)c1cccs1
Properties
Complexity:
424
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.009g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
331.364g/mol
Monoisotopic Mass:
331.009g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
144A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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