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Home > Imidazoles > 1491415-96-3
1491415-96-3 | N-(1,3-BENZOTHIAZOL-2-YL)-1H-IMIDAZOLE-4-SULFONAMIDE
CAS No: 1491415-96-3 Catalog No: AG01EIGI MDL No:MFCD19582373
Product Description
Catalog Number:
AG01EIGI
Chemical Name:
N-(1,3-BENZOTHIAZOL-2-YL)-1H-IMIDAZOLE-4-SULFONAMIDE
CAS Number:
1491415-96-3
Molecular Formula:
C10H8N4O2S2
Molecular Weight:
280.3261
MDL Number:
MFCD19582373
IUPAC Name:
N-(1,3-benzothiazol-2-yl)-1H-imidazole-5-sulfonamide
InChI:
InChI=1S/C10H8N4O2S2/c15-18(16,9-5-11-6-12-9)14-10-13-7-3-1-2-4-8(7)17-10/h1-6H,(H,11,12)(H,13,14)
InChI Key:
HBVMULGURZVBCT-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1c[nH]cn1)Nc1nc2c(s1)cccc2
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.009g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
280.32g/mol
Monoisotopic Mass:
280.009g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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