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N-{1H,2H,3H,5H,6H,7H,8H-cyclopenta[b]quinolin-9-yl}-2-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}acetamide

N-{1H,2H,3H,5H,6H,7H,8H-cyclopenta[b]quinolin-9-yl}-2-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}acetamide

Formula: C25H33N3O3

SMILES: COC1=CC=C(CCN(C)CC(=O)NC2=C3CCCC3=NC3=C2CCCC3)C=C1OC

IUPAC: N-{1H,2H,3H,5H,6H,7H,8H-cyclopenta[b]quinolin-9-yl}-2-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}acetamide

InChI: InChI=1S/C25H33N3O3/c1-28(14-13-17-11-12-22(30-2)23(15-17)31-3)16-24(29)27-25-18-7-4-5-9-20(18)26-21-10-6-8-19(21)25/h11-12,15H,4-10,13-14,16H2,1-3H3,(H,26,27,29)

Composition: C (70.89%), H (7.85%), N (9.92%), O (11.33%)

Molar Mass: 423.557

Atom Count: 64

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 423.252191935
Formal Charge 0
FSP3 0.52
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey FAUCOTAVVZTOGQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 124
Topological Polar Surface Area 63.69
Polarizability 47.04
Ring Count 4
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 C25H33N3O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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