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5-benzoyl-10-(4-nitrophenyl)-14-phenyl-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-12-one

5-benzoyl-10-(4-nitrophenyl)-14-phenyl-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-12-one

Formula: C32H25N3O4

SMILES: [O-][N+](=O)C1=CC=C(C=C1)C1NC2=CC=C(C=C2NC2=C1C(=O)CC(C2)C1=CC=CC=C1)C(=O)C1=CC=CC=C1

IUPAC: 5-benzoyl-10-(4-nitrophenyl)-14-phenyl-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-12-one

InChI: InChI=1/C32H25N3O4/c36-29-19-24(20-7-3-1-4-8-20)18-28-30(29)31(21-11-14-25(15-12-21)35(38)39)34-26-16-13-23(17-27(26)33-28)32(37)22-9-5-2-6-10-22/h1-17,24,31,33-34H,18-19H2

Composition: C (74.55%), H (4.89%), N (8.15%), O (12.41%)

Molar Mass: 515.569

Atom Count: 64

Heavy Atom Count: 39

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 2
Exact Mass 515.184506297
Formal Charge 0
FSP3 0.12
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey YVBQQIOZDOUOJG-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 153.26
Topological Polar Surface Area 101.34
Polarizability 56.56
Ring Count 6
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C32H25N3O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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