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89239-50-9 | 1H-Pyrazolo[4,3-d]pyrimidine, 7-chloro-5-cyclopropyl-1,3-dimethyl-
CAS No: 89239-50-9 Catalog No: AG00432Z MDL No:
Product Description
Catalog Number:
AG00432Z
Chemical Name:
1H-Pyrazolo[4,3-d]pyrimidine, 7-chloro-5-cyclopropyl-1,3-dimethyl-
CAS Number:
89239-50-9
Molecular Formula:
C10H11ClN4
Molecular Weight:
222.6741
IUPAC Name:
7-chloro-5-cyclopropyl-1,3-dimethylpyrazolo[4,3-d]pyrimidine
InChI:
InChI=1S/C10H11ClN4/c1-5-7-8(15(2)14-5)9(11)13-10(12-7)6-3-4-6/h6H,3-4H2,1-2H3
InChI Key:
LHDTXDSGFSJVQF-UHFFFAOYSA-N
SMILES:
Cc1nn(c2c1nc(nc2Cl)C1CC1)C
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.067g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.676g/mol
Monoisotopic Mass:
222.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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