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

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

Formula: C23H26N2O4

SMILES: COC1=CC(=CC(OC)=C1O)C1NC2=CC=CC=C2NC2=C1C(=O)CC(C)(C)C2

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

InChI: InChI=1/C23H26N2O4/c1-23(2)11-16-20(17(26)12-23)21(25-15-8-6-5-7-14(15)24-16)13-9-18(28-3)22(27)19(10-13)29-4/h5-10,21,24-25,27H,11-12H2,1-4H3

Composition: C (70.03%), H (6.64%), N (7.10%), O (16.22%)

Molar Mass: 394.471

Atom Count: 55

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 394.189257325
Formal Charge 0
FSP3 0.35
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 3
InChIKey HSSDNPOFLRIBPT-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 115.66
Topological Polar Surface Area 79.82
Polarizability 42.79
Ring Count 4
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 C23H26N2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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