Home Other Building Blocks 4-{[(5-methylpyrimidin-2-yl)sulfanyl]methyl}benzohydrazide

4-{[(5-methylpyrimidin-2-yl)sulfanyl]methyl}benzohydrazide

CAS No.:
1273571-22-4
Catalog Number:
AG01B6I8
Molecular Formula:
C13H14N4OS
Molecular Weight:
274.3415
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Product Description
Catalog Number:
AG01B6I8
Chemical Name:
4-{[(5-methylpyrimidin-2-yl)sulfanyl]methyl}benzohydrazide
CAS Number:
1273571-22-4
Molecular Formula:
C13H14N4OS
Molecular Weight:
274.3415
MDL Number:
MFCD18598384
IUPAC Name:
4-[(5-methylpyrimidin-2-yl)sulfanylmethyl]benzohydrazide
InChI:
InChI=1S/C13H14N4OS/c1-9-6-15-13(16-7-9)19-8-10-2-4-11(5-3-10)12(18)17-14/h2-7H,8,14H2,1H3,(H,17,18)
InChI Key:
AVHJCCUMBJUUNS-UHFFFAOYSA-N
SMILES:
NNC(=O)c1ccc(cc1)CSc1ncc(cn1)C
Properties
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.089g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
274.342g/mol
Monoisotopic Mass:
274.089g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties