Home Halogens 3-[(6-chloropyrimidin-4-yl)amino]propanamide

3-[(6-chloropyrimidin-4-yl)amino]propanamide

CAS No.:
1250489-59-8
Catalog Number:
AG019YEM
Molecular Formula:
C7H9ClN4O
Molecular Weight:
200.6256
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Product Description
Catalog Number:
AG019YEM
Chemical Name:
3-[(6-chloropyrimidin-4-yl)amino]propanamide
CAS Number:
1250489-59-8
Molecular Formula:
C7H9ClN4O
Molecular Weight:
200.6256
MDL Number:
MFCD14611235
IUPAC Name:
3-[(6-chloropyrimidin-4-yl)amino]propanamide
InChI:
InChI=1S/C7H9ClN4O/c8-5-3-7(12-4-11-5)10-2-1-6(9)13/h3-4H,1-2H2,(H2,9,13)(H,10,11,12)
InChI Key:
REIFQFOKZOROAE-UHFFFAOYSA-N
SMILES:
NC(=O)CCNc1cc(Cl)ncn1
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.046g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
200.626g/mol
Monoisotopic Mass:
200.046g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties