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326903-19-9 | 12-(4-CHLOROPHENYL)-9,9-DIMETHYL-8,9,10,12-TETRAHYDRO-7H-BENZO[A]ACRIDIN-11-ONE
CAS No: 326903-19-9 Catalog No: AG01FFLO MDL No:
Product Description
Catalog Number:
AG01FFLO
Chemical Name:
12-(4-CHLOROPHENYL)-9,9-DIMETHYL-8,9,10,12-TETRAHYDRO-7H-BENZO[A]ACRIDIN-11-ONE
CAS Number:
326903-19-9
Molecular Formula:
C25H22ClNO
Molecular Weight:
387.9013
IUPAC Name:
12-(4-chlorophenyl)-9,9-dimethyl-7,8,10,12-tetrahydrobenzo[a]acridin-11-one
InChI:
InChI=1S/C25H22ClNO/c1-25(2)13-20-24(21(28)14-25)22(16-7-10-17(26)11-8-16)23-18-6-4-3-5-15(18)9-12-19(23)27-20/h3-12,22,27H,13-14H2,1-2H3
InChI Key:
GTDAMOQWZBCSDN-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C1C2=C(Nc3c1c1ccccc1cc3)CC(CC2=O)(C)C
Properties
Complexity:
660
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
387.139g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
387.907g/mol
Monoisotopic Mass:
387.139g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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