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4-butoxy-N-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]benzamide

4-butoxy-N-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]benzamide

Formula: C24H21ClN2O3

SMILES: CCCCOC1=CC=C(C=C1)C(=O)NC1=CC=C2OC(=NC2=C1)C1=CC=C(Cl)C=C1

IUPAC: 4-butoxy-N-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]benzamide

InChI: InChI=1S/C24H21ClN2O3/c1-2-3-14-29-20-11-6-16(7-12-20)23(28)26-19-10-13-22-21(15-19)27-24(30-22)17-4-8-18(25)9-5-17/h4-13,15H,2-3,14H2,1H3,(H,26,28)

Composition: C (68.49%), H (5.03%), Cl (8.42%), N (6.66%), O (11.40%)

Molar Mass: 420.89

Atom Count: 51

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 420.1240702
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey RHFLMGXOCITVLI-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 128.5
Topological Polar Surface Area 64.36
Polarizability 46.62
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 C24H21ClN2O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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