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89239-45-2 | 1H-Pyrazolo[4,3-d]pyrimidine, 7-(1-aziridinyl)-5-ethyl-1,3-dimethyl-
CAS No: 89239-45-2 Catalog No: AG004330 MDL No:
Product Description
Catalog Number:
AG004330
Chemical Name:
1H-Pyrazolo[4,3-d]pyrimidine, 7-(1-aziridinyl)-5-ethyl-1,3-dimethyl-
CAS Number:
89239-45-2
Molecular Formula:
C11H15N5
Molecular Weight:
217.2703
IUPAC Name:
7-(aziridin-1-yl)-5-ethyl-1,3-dimethylpyrazolo[4,3-d]pyrimidine
InChI:
InChI=1S/C11H15N5/c1-4-8-12-9-7(2)14-15(3)10(9)11(13-8)16-5-6-16/h4-6H2,1-3H3
InChI Key:
HLDZNBHLRMXXHH-UHFFFAOYSA-N
SMILES:
CCc1nc(N2CC2)c2c(n1)c(C)nn2C
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.133g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.276g/mol
Monoisotopic Mass:
217.133g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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