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122252-37-3 | Benzenesulfonamide, N-[(1,3,5-triazin-2-ylamino)carbonyl]-
CAS No: 122252-37-3 Catalog No: AG0016ZZ MDL No:
Product Description
Catalog Number:
AG0016ZZ
Chemical Name:
Benzenesulfonamide, N-[(1,3,5-triazin-2-ylamino)carbonyl]-
CAS Number:
122252-37-3
Molecular Formula:
C10H9N5O3S
Molecular Weight:
279.2752
IUPAC Name:
1-(benzenesulfonyl)-3-(1,3,5-triazin-2-yl)urea
InChI:
InChI=1S/C10H9N5O3S/c16-10(14-9-12-6-11-7-13-9)15-19(17,18)8-4-2-1-3-5-8/h1-7H,(H2,11,12,13,14,15,16)
InChI Key:
VYNVBYXEUNPOFO-UHFFFAOYSA-N
SMILES:
O=C(NS(=O)(=O)c1ccccc1)Nc1ncncn1
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.043g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
279.274g/mol
Monoisotopic Mass:
279.043g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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