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(2E)-3-({4'-[(2E)-3-carboxyprop-2-enamido]-[1,1'-biphenyl]-4-yl}carbamoyl)prop-2-enoic acid

(2E)-3-({4'-[(2E)-3-carboxyprop-2-enamido]-[1,1'-biphenyl]-4-yl}carbamoyl)prop-2-enoic acid

Formula: C20H16N2O6

SMILES: OC(=O)C=CC(=O)NC1=CC=C(C=C1)C1=CC=C(NC(=O)C=CC(O)=O)C=C1

IUPAC: (2E)-3-({4'-[(2E)-3-carboxyprop-2-enamido]-[1,1'-biphenyl]-4-yl}carbamoyl)prop-2-enoic acid

InChI: InChI=1S/C20H16N2O6/c23-17(9-11-19(25)26)21-15-5-1-13(2-6-15)14-3-7-16(8-4-14)22-18(24)10-12-20(27)28/h1-12H,(H,21,23)(H,22,24)(H,25,26)(H,27,28)/b11-9+,12-10+

Composition: C (63.16%), H (4.24%), N (7.37%), O (25.24%)

Molar Mass: 380.356

Atom Count: 44

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 380.100836243
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 4
InChIKey FTLRWRKPUWMOMS-WGDLNXRISA-N
Lipinski's Rule of Five 1
Molar Refractivity 104.85
Topological Polar Surface Area 132.8
Polarizability 38.95
Ring Count 2
Rotatable Bond Count 7

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Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H16N2O6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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