Home Other Building Blocks pyrimido[4,5-d][1,3]diazin-2-amine

pyrimido[4,5-d][1,3]diazin-2-amine

CAS No.:
1314927-80-4
Catalog Number:
AG01ALEE
Molecular Formula:
C6H5N5
Molecular Weight:
147.1374
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Product Description
Catalog Number:
AG01ALEE
Chemical Name:
pyrimido[4,5-d][1,3]diazin-2-amine
CAS Number:
1314927-80-4
Molecular Formula:
C6H5N5
Molecular Weight:
147.1374
MDL Number:
MFCD19208627
IUPAC Name:
pyrimido[4,5-d]pyrimidin-2-amine
InChI:
InChI=1S/C6H5N5/c7-6-9-2-4-1-8-3-10-5(4)11-6/h1-3H,(H2,7,8,9,10,11)
InChI Key:
XMNVBOSLZWOYFC-UHFFFAOYSA-N
SMILES:
Nc1ncc2c(n1)ncnc2
Properties
Complexity:
139  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.054g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
147.141g/mol
Monoisotopic Mass:
147.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
77.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties