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4,7-bis(4-methoxyphenyl)-2-methyl-1,4,8-triazatricyclo[6.3.0.0²,?]undecane-3,5-dione

4,7-bis(4-methoxyphenyl)-2-methyl-1,4,8-triazatricyclo[6.3.0.0²,?]undecane-3,5-dione

Formula: C23H25N3O4

SMILES: COC1=CC=C(C=C1)C1C2C(=O)N(C(=O)C2(C)N2CCCN12)C1=CC=C(OC)C=C1

IUPAC: 4,7-bis(4-methoxyphenyl)-2-methyl-1,4,8-triazatricyclo[6.3.0.0²,?]undecane-3,5-dione

InChI: InChI=1/C23H25N3O4/c1-23-19(21(27)26(22(23)28)16-7-11-18(30-3)12-8-16)20(24-13-4-14-25(23)24)15-5-9-17(29-2)10-6-15/h5-12,19-20H,4,13-14H2,1-3H3

Composition: C (67.80%), H (6.18%), N (10.31%), O (15.71%)

Molar Mass: 407.47

Atom Count: 55

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 3
Exact Mass 407.184506297
Formal Charge 0
FSP3 0.39
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 0
InChIKey BBNZBKJIGYHXIZ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 110.73
Topological Polar Surface Area 62.32
Polarizability 43.46
Ring Count 5
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H25N3O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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