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Home > Pyridines > 220654-99-9
220654-99-9 | 6-Methyl-2,4-dioxo-N'-5'-(4-pyridylcarbonyl)-1,2,3,4-tetrahydro-5-pyrimidinesulfonohydrazide
CAS No: 220654-99-9 Catalog No: AG00J9VP MDL No:MFCD02339902
Product Description
Catalog Number:
AG00J9VP
Chemical Name:
6-Methyl-2,4-dioxo-N'-5'-(4-pyridylcarbonyl)-1,2,3,4-tetrahydro-5-pyrimidinesulfonohydrazide
CAS Number:
220654-99-9
Molecular Formula:
C11H11N5O5S
Molecular Weight:
325.3005
MDL Number:
MFCD02339902
IUPAC Name:
N'-[(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)sulfonyl]pyridine-4-carbohydrazide
InChI:
InChI=1S/C11H11N5O5S/c1-6-8(10(18)14-11(19)13-6)22(20,21)16-15-9(17)7-2-4-12-5-3-7/h2-5,16H,1H3,(H,15,17)(H2,13,14,18,19)
InChI Key:
WMPAXWJRRGZHCP-UHFFFAOYSA-N
SMILES:
O=C(c1ccncc1)NNS(=O)(=O)c1c(C)[nH]c(=O)[nH]c1=O
EC Number:
606-923-0
Properties
Complexity:
630
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.048g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
325.299g/mol
Monoisotopic Mass:
325.048g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
155A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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