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

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

Formula: C25H23N3O2

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

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

InChI: InChI=1/C25H23N3O2/c1-30-19-10-8-16(9-11-19)18-13-22-24(23(29)14-18)25(17-5-4-12-26-15-17)28-21-7-3-2-6-20(21)27-22/h2-12,15,18,25,27-28H,13-14H2,1H3

Composition: C (75.55%), H (5.83%), N (10.57%), O (8.05%)

Molar Mass: 397.478

Atom Count: 53

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 2
Exact Mass 397.179026993
Formal Charge 0
FSP3 0.2
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey LGOYQBBPCORYTC-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 120.67
Topological Polar Surface Area 63.25
Polarizability 44.68
Ring Count 5
Rotatable Bond Count 3

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C25H23N3O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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