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9-acetyl-5-benzoyl-10-(4-ethoxyphenyl)-14,14-dimethyl-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3(8),4,6-tetraen-12-one

9-acetyl-5-benzoyl-10-(4-ethoxyphenyl)-14,14-dimethyl-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3(8),4,6-tetraen-12-one

Formula: C32H32N2O4

SMILES: CCOC1=CC=C(C=C1)C1N(C(C)=O)C2=C(NC3=C1C(=O)CC(C)(C)C3)C=C(C=C2)C(=O)C1=CC=CC=C1

IUPAC: 9-acetyl-5-benzoyl-10-(4-ethoxyphenyl)-14,14-dimethyl-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3(8),4,6-tetraen-12-one

InChI: InChI=1/C32H32N2O4/c1-5-38-24-14-11-21(12-15-24)30-29-26(18-32(3,4)19-28(29)36)33-25-17-23(13-16-27(25)34(30)20(2)35)31(37)22-9-7-6-8-10-22/h6-17,30,33H,5,18-19H2,1-4H3

Composition: C (75.57%), H (6.34%), N (5.51%), O (12.58%)

Molar Mass: 508.618

Atom Count: 70

Heavy Atom Count: 38

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 508.236207518
Formal Charge 0
FSP3 0.28
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey RHIWNPRNVMZUPY-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 150.32
Topological Polar Surface Area 75.71
Polarizability 56.89
Ring Count 5
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C32H32N2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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