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Home > Imidazoles > 524037-03-4
524037-03-4 | 3-nitro-5H-benzimidazo[1,2-a][3,1]benzothiazine
CAS No: 524037-03-4 Catalog No: AG00JGT0 MDL No:MFCD03197154
Product Description
Catalog Number:
AG00JGT0
Chemical Name:
3-nitro-5H-benzimidazo[1,2-a][3,1]benzothiazine
CAS Number:
524037-03-4
Molecular Formula:
C14H9N3O2S
Molecular Weight:
283.3052
MDL Number:
MFCD03197154
IUPAC Name:
3-nitro-5H-benzimidazolo[1,2-a][3,1]benzothiazine
InChI:
InChI=1S/C14H9N3O2S/c18-17(19)10-5-6-12-9(7-10)8-20-14-15-11-3-1-2-4-13(11)16(12)14/h1-7H,8H2
InChI Key:
DRBYJEQYBVUMKA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)CSc1n2c2ccccc2n1
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.042g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.305g/mol
Monoisotopic Mass:
283.042g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
88.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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