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2-chloro-N-{3-[2-(4-cyclohexylphenoxy)acetamido]phenyl}benzamide

2-chloro-N-{3-[2-(4-cyclohexylphenoxy)acetamido]phenyl}benzamide

Formula: C27H27ClN2O3

SMILES: ClC1=CC=CC=C1C(=O)NC1=CC(NC(=O)COC2=CC=C(C=C2)C2CCCCC2)=CC=C1

IUPAC: 2-chloro-N-{3-[2-(4-cyclohexylphenoxy)acetamido]phenyl}benzamide

InChI: InChI=1S/C27H27ClN2O3/c28-25-12-5-4-11-24(25)27(32)30-22-10-6-9-21(17-22)29-26(31)18-33-23-15-13-20(14-16-23)19-7-2-1-3-8-19/h4-6,9-17,19H,1-3,7-8,18H2,(H,29,31)(H,30,32)

Composition: C (70.05%), H (5.88%), Cl (7.66%), N (6.05%), O (10.37%)

Molar Mass: 462.97

Atom Count: 60

Heavy Atom Count: 33

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 462.1710204
Formal Charge 0
FSP3 0.26
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey AOZQMJUEIHZTEI-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 133.41
Topological Polar Surface Area 67.43
Polarizability 50.21
Ring Count 4
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C27H27ClN2O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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