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4-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}-N-ethyl-N-phenylbenzamide

4-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}-N-ethyl-N-phenylbenzamide

Formula: C24H22N2O3

SMILES: CCN(C(=O)C1=CC=C(C=C1)N1C(=O)C2C3CC(C=C3)C2C1=O)C1=CC=CC=C1

IUPAC: 4-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}-N-ethyl-N-phenylbenzamide

InChI: InChI=1/C24H22N2O3/c1-2-25(18-6-4-3-5-7-18)22(27)15-10-12-19(13-11-15)26-23(28)20-16-8-9-17(14-16)21(20)24(26)29/h3-13,16-17,20-21H,2,14H2,1H3

Composition: C (74.59%), H (5.74%), N (7.25%), O (12.42%)

Molar Mass: 386.451

Atom Count: 51

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 4
Exact Mass 386.163042576
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey NQHBZRVTDRYOET-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 110.71
Topological Polar Surface Area 57.69
Polarizability 42.03
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 C24H22N2O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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