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74382-17-5 | 1H-Cyclopenta[4,5]pyrrolo[3,2-e]benzimidazole(9CI)
CAS No: 74382-17-5 Catalog No: AG008QDL MDL No:
Product Description
Catalog Number:
AG008QDL
Chemical Name:
1H-Cyclopenta[4,5]pyrrolo[3,2-e]benzimidazole(9CI)
CAS Number:
74382-17-5
Molecular Formula:
C12H7N3
Molecular Weight:
193.2041
IUPAC Name:
3,5,10-triazatetracyclo[7.6.0.02,6.011,15]pentadeca-1(15),2,4,6,8,11,13-heptaene
InChI:
InChI=1S/C12H7N3/c1-2-7-8(3-1)15-9-4-5-10-12(11(7)9)14-6-13-10/h1-6,15H
InChI Key:
WEAAIBBTNKUEOI-UHFFFAOYSA-N
SMILES:
C1=CC2=Nc3c(C2=C1)c1[nH]cnc1cc3
Properties
Complexity:
592
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.064g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.209g/mol
Monoisotopic Mass:
193.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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