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920317-12-0 | 1H-Imidazo[2,1-b]purine, 1-methyl-4-(1-pyrrolidinyl)-
CAS No: 920317-12-0 Catalog No: AG006EOY MDL No:
Product Description
Catalog Number:
AG006EOY
Chemical Name:
1H-Imidazo[2,1-b]purine, 1-methyl-4-(1-pyrrolidinyl)-
CAS Number:
920317-12-0
Molecular Formula:
C12H14N6
Molecular Weight:
242.2798
IUPAC Name:
1-methyl-4-pyrrolidin-1-ylimidazo[2,1-b]purine
InChI:
InChI=1S/C12H14N6/c1-16-8-14-9-10(17-5-2-3-6-17)15-12-13-4-7-18(12)11(9)16/h4,7-8H,2-3,5-6H2,1H3
InChI Key:
MNOARXMFYKIVEG-UHFFFAOYSA-N
SMILES:
Cn1cnc2c1n1ccnc1nc2N1CCCC1
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.128g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.286g/mol
Monoisotopic Mass:
242.128g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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