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101850-43-5 | Pyrimido[5,4-d]pyrimidin-4-amine, 2,8-dichloro-N,N-diethyl-
CAS No: 101850-43-5 Catalog No: AG0005QI MDL No:
Product Description
Catalog Number:
AG0005QI
Chemical Name:
Pyrimido[5,4-d]pyrimidin-4-amine, 2,8-dichloro-N,N-diethyl-
CAS Number:
101850-43-5
Molecular Formula:
C10H11Cl2N5
Molecular Weight:
272.1338
IUPAC Name:
2,8-dichloro-N,N-diethylpyrimido[5,4-d]pyrimidin-4-amine
InChI:
InChI=1S/C10H11Cl2N5/c1-3-17(4-2)9-7-6(15-10(12)16-9)8(11)14-5-13-7/h5H,3-4H2,1-2H3
InChI Key:
UOPRPCBCBQMLEB-UHFFFAOYSA-N
SMILES:
CCN(c1nc(Cl)nc2c1ncnc2Cl)CC
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.039g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.133g/mol
Monoisotopic Mass:
271.039g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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