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2,4,6,8-tetrakis(2-methoxyphenyl)-3,7-diazabicyclo[3.3.1]nonan-9-one

2,4,6,8-tetrakis(2-methoxyphenyl)-3,7-diazabicyclo[3.3.1]nonan-9-one

Formula: C35H36N2O5

SMILES: COC1=CC=CC=C1C1NC(C2C(NC(C1C2=O)C1=CC=CC=C1OC)C1=CC=CC=C1OC)C1=CC=CC=C1OC

IUPAC: 2,4,6,8-tetrakis(2-methoxyphenyl)-3,7-diazabicyclo[3.3.1]nonan-9-one

InChI: InChI=1/C35H36N2O5/c1-39-25-17-9-5-13-21(25)31-29-32(22-14-6-10-18-26(22)40-2)37-34(24-16-8-12-20-28(24)42-4)30(35(29)38)33(36-31)23-15-7-11-19-27(23)41-3/h5-20,29-34,36-37H,1-4H3

Composition: C (74.45%), H (6.43%), N (4.96%), O (14.17%)

Molar Mass: 564.682

Atom Count: 78

Heavy Atom Count: 42

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 4
Exact Mass 564.262422267
Formal Charge 0
FSP3 0.29
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 2
InChIKey ISMZWGPNPCOVDV-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 161.02
Topological Polar Surface Area 78.05
Polarizability 63.74
Ring Count 6
Rotatable Bond Count 8

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C35H36N2O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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