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11-(3,4-dichlorophenyl)-3,5,7-trimethyl-4-(4-methylphenyl)-4,8,9-triazatricyclo[7.3.0.0²,?]dodeca-1(12),2,5,7,10-pentaene

11-(3,4-dichlorophenyl)-3,5,7-trimethyl-4-(4-methylphenyl)-4,8,9-triazatricyclo[7.3.0.0²,?]dodeca-1(12),2,5,7,10-pentaene

Formula: C25H21Cl2N3

SMILES: CC1=C2C3=CC(=CN3N=C(C)C2=C(C)N1C1=CC=C(C)C=C1)C1=CC=C(Cl)C(Cl)=C1

IUPAC: 11-(3,4-dichlorophenyl)-3,5,7-trimethyl-4-(4-methylphenyl)-4,8,9-triazatricyclo[7.3.0.0²,?]dodeca-1(12),2,5,7,10-pentaene

InChI: InChI=1S/C25H21Cl2N3/c1-14-5-8-20(9-6-14)30-16(3)24-15(2)28-29-13-19(12-23(29)25(24)17(30)4)18-7-10-21(26)22(27)11-18/h5-13H,1-4H3

Composition: C (69.13%), H (4.87%), Cl (16.32%), N (9.67%)

Molar Mass: 434.36

Atom Count: 51

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 5
Asymmetric Atom Count 0
Exact Mass 433.1112531
Formal Charge 0
FSP3 0.16
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey QRYBHNOCSFIWON-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 146.86
Topological Polar Surface Area 22.23
Polarizability 51.3
Ring Count 5
Rotatable Bond Count 2

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C25H21Cl2N3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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