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

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

Formula: C20H21N3

SMILES: CC1=CN2N=C(C)C3=C(C)N(C(C)=C3C2=C1)C1=CC=C(C)C=C1

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

InChI: InChI=1S/C20H21N3/c1-12-6-8-17(9-7-12)23-15(4)19-14(3)21-22-11-13(2)10-18(22)20(19)16(23)5/h6-11H,1-5H3

Composition: C (79.17%), H (6.98%), N (13.85%)

Molar Mass: 303.409

Atom Count: 44

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 303.173547688
Formal Charge 0
FSP3 0.25
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey WMIQZRAJUIOLFW-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 117.15
Topological Polar Surface Area 22.23
Polarizability 38.42
Ring Count 4
Rotatable Bond Count 1

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H21N3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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