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Home > Pyridines > 865074-37-9
865074-37-9 | 1-(5-Methylpyridin-2-yl)-3-(piperidine-1-sulfonyl)urea
CAS No: 865074-37-9 Catalog No: AG01EXX7 MDL No:MFCD06637866
Product Description
Catalog Number:
AG01EXX7
Chemical Name:
1-(5-Methylpyridin-2-yl)-3-(piperidine-1-sulfonyl)urea
CAS Number:
865074-37-9
Molecular Formula:
C12H18N4O3S
Molecular Weight:
298.3613
MDL Number:
MFCD06637866
IUPAC Name:
1-(5-methylpyridin-2-yl)-3-piperidin-1-ylsulfonylurea
InChI:
InChI=1S/C12H18N4O3S/c1-10-5-6-11(13-9-10)14-12(17)15-20(18,19)16-7-3-2-4-8-16/h5-6,9H,2-4,7-8H2,1H3,(H2,13,14,15,17)
InChI Key:
UIJLYUIPNZOTLC-UHFFFAOYSA-N
SMILES:
O=C(NS(=O)(=O)N1CCCCC1)Nc1ccc(cn1)C
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.11g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
298.361g/mol
Monoisotopic Mass:
298.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
99.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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