Home Other Building Blocks 4-[(pyrimidin-2-ylsulfanyl)methyl]benzohydrazide

4-[(pyrimidin-2-ylsulfanyl)methyl]benzohydrazide

CAS No.:
1410179-54-2
Catalog Number:
AG01B6YD
Molecular Formula:
C12H12N4OS
Molecular Weight:
260.3149
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Product Description
Catalog Number:
AG01B6YD
Chemical Name:
4-[(pyrimidin-2-ylsulfanyl)methyl]benzohydrazide
CAS Number:
1410179-54-2
Molecular Formula:
C12H12N4OS
Molecular Weight:
260.3149
MDL Number:
MFCD18594003
IUPAC Name:
4-(pyrimidin-2-ylsulfanylmethyl)benzohydrazide
InChI:
InChI=1S/C12H12N4OS/c13-16-11(17)10-4-2-9(3-5-10)8-18-12-14-6-1-7-15-12/h1-7H,8,13H2,(H,16,17)
InChI Key:
NXUFLXMBJVXILL-UHFFFAOYSA-N
SMILES:
NNC(=O)c1ccc(cc1)CSc1ncccn1
Properties
Complexity:
263  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.073g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
260.315g/mol
Monoisotopic Mass:
260.073g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties