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88536-36-1 | 3-Piperidinone, 1-[4,6-bis(2-propenylamino)-1,3,5-triazin-2-yl]-
CAS No: 88536-36-1 Catalog No: AG0046O0 MDL No:
Product Description
Catalog Number:
AG0046O0
Chemical Name:
3-Piperidinone, 1-[4,6-bis(2-propenylamino)-1,3,5-triazin-2-yl]-
CAS Number:
88536-36-1
Molecular Formula:
C14H20N6O
Molecular Weight:
288.3482
IUPAC Name:
1-[4,6-bis(prop-2-enylamino)-1,3,5-triazin-2-yl]piperidin-3-one
InChI:
InChI=1S/C14H20N6O/c1-3-7-15-12-17-13(16-8-4-2)19-14(18-12)20-9-5-6-11(21)10-20/h3-4H,1-2,5-10H2,(H2,15,16,17,18,19)
InChI Key:
YTCZSJLGRFROFB-UHFFFAOYSA-N
SMILES:
C=CCNc1nc(NCC=C)nc(n1)N1CCCC(=O)C1
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.17g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
288.355g/mol
Monoisotopic Mass:
288.17g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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