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156601-60-4 | 4H-Pyrrolo[3,2-d]pyrimidin-4-one, 7-(cyclopentylmethyl)-3,5-dihydro-
CAS No: 156601-60-4 Catalog No: AG001OUN MDL No:
Product Description
Catalog Number:
AG001OUN
Chemical Name:
4H-Pyrrolo[3,2-d]pyrimidin-4-one, 7-(cyclopentylmethyl)-3,5-dihydro-
CAS Number:
156601-60-4
Molecular Formula:
C12H15N3O
Molecular Weight:
217.2670
IUPAC Name:
7-(cyclopentylmethyl)-3,5-dihydropyrrolo[3,2-d]pyrimidin-4-one
InChI:
InChI=1S/C12H15N3O/c16-12-11-10(14-7-15-12)9(6-13-11)5-8-3-1-2-4-8/h6-8,13H,1-5H2,(H,14,15,16)
InChI Key:
LUYOAOZVQYOVFL-UHFFFAOYSA-N
SMILES:
O=c1[nH]cnc2c1[nH]cc2CC1CCCC1
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.122g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
217.272g/mol
Monoisotopic Mass:
217.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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