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71435-37-5 | 4H-Pyrrolo[3,2-d]pyrimidin-4-one,3,5-dihydro-7-methyl-
CAS No: 71435-37-5 Catalog No: AG005IL8 MDL No:
Product Description
Catalog Number:
AG005IL8
Chemical Name:
4H-Pyrrolo[3,2-d]pyrimidin-4-one,3,5-dihydro-7-methyl-
CAS Number:
71435-37-5
Molecular Formula:
C7H7N3O
Molecular Weight:
149.1500
IUPAC Name:
7-methyl-3,5-dihydropyrrolo[3,2-d]pyrimidin-4-one
InChI:
InChI=1S/C7H7N3O/c1-4-2-8-6-5(4)9-3-10-7(6)11/h2-3,8H,1H3,(H,9,10,11)
InChI Key:
AWETXMHQKQROTA-UHFFFAOYSA-N
SMILES:
Cc1c[nH]c2c1[nH]cnc2=O
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.059g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
149.153g/mol
Monoisotopic Mass:
149.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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