Home Halogens Pyrido[4,​3-​d]​pyrimidin-​5(6H)​-​one, 2,​4-​dichloro-​7,​8-​dihydro-

Pyrido[4,​3-​d]​pyrimidin-​5(6H)​-​one, 2,​4-​dichloro-​7,​8-​dihydro-

CAS No.:
1393572-20-7
Catalog Number:
AG001AU6
Molecular Formula:
C7H5Cl2N3O
Molecular Weight:
218.0401
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Product Description
Catalog Number:
AG001AU6
Chemical Name:
Pyrido[4,​3-​d]​pyrimidin-​5(6H)​-​one, 2,​4-​dichloro-​7,​8-​dihydro-
CAS Number:
1393572-20-7
Molecular Formula:
C7H5Cl2N3O
Molecular Weight:
218.0401
IUPAC Name:
2,4-dichloro-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
InChI:
InChI=1S/C7H5Cl2N3O/c8-5-4-3(11-7(9)12-5)1-2-10-6(4)13/h1-2H2,(H,10,13)
InChI Key:
ZGCMCEDKBAMANU-UHFFFAOYSA-N
SMILES:
Clc1nc2CCNC(=O)c2c(n1)Cl
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.981g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.037g/mol
Monoisotopic Mass:
216.981g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties