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

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

Formula: C32H28N2O3

SMILES: COC1=CC=C(C=C1)C1CC(=O)C2=C(C1)NC1=CC=CC=C1NC2C1=CC=CC(OC2=CC=CC=C2)=C1

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

InChI: InChI=1/C32H28N2O3/c1-36-24-16-14-21(15-17-24)23-19-29-31(30(35)20-23)32(34-28-13-6-5-12-27(28)33-29)22-8-7-11-26(18-22)37-25-9-3-2-4-10-25/h2-18,23,32-34H,19-20H2,1H3

Composition: C (78.67%), H (5.78%), N (5.73%), O (9.82%)

Molar Mass: 488.587

Atom Count: 65

Heavy Atom Count: 37

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 2
Exact Mass 488.20999277
Formal Charge 0
FSP3 0.16
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey DMUDWIOTLUACFS-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 149.07
Topological Polar Surface Area 59.59
Polarizability 55.93
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 C32H28N2O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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