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N-[4-(5-benzoyl-1H-1,3-benzodiazol-2-yl)phenyl]-2-chlorobenzamide

N-[4-(5-benzoyl-1H-1,3-benzodiazol-2-yl)phenyl]-2-chlorobenzamide

Formula: C27H18ClN3O2

SMILES: ClC1=CC=CC=C1C(=O)NC1=CC=C(C=C1)C1=NC2=CC(=CC=C2N1)C(=O)C1=CC=CC=C1

IUPAC: N-[4-(5-benzoyl-1H-1,3-benzodiazol-2-yl)phenyl]-2-chlorobenzamide

InChI: InChI=1S/C27H18ClN3O2/c28-22-9-5-4-8-21(22)27(33)29-20-13-10-18(11-14-20)26-30-23-15-12-19(16-24(23)31-26)25(32)17-6-2-1-3-7-17/h1-16H,(H,29,33)(H,30,31)

Composition: C (71.76%), H (4.01%), Cl (7.84%), N (9.30%), O (7.08%)

Molar Mass: 451.91

Atom Count: 51

Heavy Atom Count: 33

Properties
Properties
Common Names N/A
Aromatic Ring Count 5
Asymmetric Atom Count 0
Exact Mass 451.1087545
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey XIWLYHZDPONPQN-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 140.98
Topological Polar Surface Area 74.85
Polarizability 51.08
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 C27H18ClN3O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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