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1566127-25-0

1566127-25-0 | 2-(3-METHYLTHIOMORPHOLIN-4-YL)PYRIMIDINE-5-CARBALDEHYDE

CAS No: 1566127-25-0 Catalog No: AG01C8RT MDL No:MFCD26843494

Product Description

Catalog Number:
AG01C8RT
Chemical Name:
2-(3-METHYLTHIOMORPHOLIN-4-YL)PYRIMIDINE-5-CARBALDEHYDE
CAS Number:
1566127-25-0
Molecular Formula:
C10H13N3OS
Molecular Weight:
223.2947
MDL Number:
MFCD26843494
IUPAC Name:
2-(3-methylthiomorpholin-4-yl)pyrimidine-5-carbaldehyde
InChI:
InChI=1S/C10H13N3OS/c1-8-7-15-3-2-13(8)10-11-4-9(6-14)5-12-10/h4-6,8H,2-3,7H2,1H3
InChI Key:
CGPIOYXRNGZGLP-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(nc1)N1CCSCC1C

Properties

Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.078g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.294g/mol
Monoisotopic Mass:
223.078g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

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