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Home > Imidazoles > 18007-13-1
18007-13-1 | Benz[f]imidazo[1,5-a]quinolin-3(2H)-one, 1,11,12,12a-tetrahydro-2-(phenylmethyl)-
CAS No: 18007-13-1 Catalog No: AG0021OS MDL No:
Product Description
Catalog Number:
AG0021OS
Chemical Name:
Benz[f]imidazo[1,5-a]quinolin-3(2H)-one, 1,11,12,12a-tetrahydro-2-(phenylmethyl)-
CAS Number:
18007-13-1
Molecular Formula:
C22H20N2O
Molecular Weight:
328.4070
IUPAC Name:
13-benzyl-11,13-diazatetracyclo[8.7.0.02,7.011,15]heptadeca-1(10),2,4,6,8-pentaen-12-one
InChI:
InChI=1S/C22H20N2O/c25-22-23(14-16-6-2-1-3-7-16)15-18-11-12-20-19-9-5-4-8-17(19)10-13-21(20)24(18)22/h1-10,13,18H,11-12,14-15H2
InChI Key:
UDWATOXQUUJYOF-UHFFFAOYSA-N
SMILES:
O=C1N(Cc2ccccc2)CC2N1c1ccc3c(c1CC2)cccc3
NSC Number:
111578
Properties
Complexity:
500
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.158g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.415g/mol
Monoisotopic Mass:
328.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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