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ethyl 5-[(2E)-3-(3,5-dichloro-2-methoxyphenyl)prop-2-enamido]-2-(morpholin-4-yl)benzoate

ethyl 5-[(2E)-3-(3,5-dichloro-2-methoxyphenyl)prop-2-enamido]-2-(morpholin-4-yl)benzoate

Formula: C23H24Cl2N2O5

SMILES: CCOC(=O)C1=CC(NC(=O)C=CC2=CC(Cl)=CC(Cl)=C2OC)=CC=C1N1CCOCC1

IUPAC: ethyl 5-[(2E)-3-(3,5-dichloro-2-methoxyphenyl)prop-2-enamido]-2-(morpholin-4-yl)benzoate

InChI: InChI=1S/C23H24Cl2N2O5/c1-3-32-23(29)18-14-17(5-6-20(18)27-8-10-31-11-9-27)26-21(28)7-4-15-12-16(24)13-19(25)22(15)30-2/h4-7,12-14H,3,8-11H2,1-2H3,(H,26,28)/b7-4+

Composition: C (57.63%), H (5.05%), Cl (14.79%), N (5.84%), O (16.69%)

Molar Mass: 479.35

Atom Count: 56

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 478.1062273
Formal Charge 0
FSP3 0.3
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey NJROTUOMZOLFPR-QPJJXVBHSA-N
Lipinski's Rule of Five 1
Molar Refractivity 127.69
Topological Polar Surface Area 77.1
Polarizability 47.48
Ring Count 3
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 C23H24Cl2N2O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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