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1311315-77-1 | 2-methyl-5-(4-methyl-1,3-thiazol-2-yl)-3,4-dihydropyrimidin-4-one
CAS No: 1311315-77-1 Catalog No: AG01AIMI MDL No:MFCD18917332
Product Description
Catalog Number:
AG01AIMI
Chemical Name:
2-methyl-5-(4-methyl-1,3-thiazol-2-yl)-3,4-dihydropyrimidin-4-one
CAS Number:
1311315-77-1
Molecular Formula:
C9H9N3OS
Molecular Weight:
207.2523
MDL Number:
MFCD18917332
IUPAC Name:
2-methyl-5-(4-methyl-1,3-thiazol-2-yl)-1H-pyrimidin-6-one
InChI:
InChI=1S/C9H9N3OS/c1-5-4-14-9(11-5)7-3-10-6(2)12-8(7)13/h3-4H,1-2H3,(H,10,12,13)
InChI Key:
YOMAWXZBPGFYNK-UHFFFAOYSA-N
SMILES:
Cc1csc(n1)c1cnc([nH]c1=O)C
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.047g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.251g/mol
Monoisotopic Mass:
207.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
82.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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