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N-[2-chloro-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-methoxybenzamide

N-[2-chloro-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-methoxybenzamide

Formula: C22H17ClN2O3

SMILES: COC1=CC=CC(=C1)C(=O)NC1=CC(=CC=C1Cl)C1=NC2=CC=C(C)C=C2O1

IUPAC: N-[2-chloro-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-methoxybenzamide

InChI: InChI=1S/C22H17ClN2O3/c1-13-6-9-18-20(10-13)28-22(25-18)15-7-8-17(23)19(12-15)24-21(26)14-4-3-5-16(11-14)27-2/h3-12H,1-2H3,(H,24,26)

Composition: C (67.26%), H (4.36%), Cl (9.02%), N (7.13%), O (12.22%)

Molar Mass: 392.84

Atom Count: 45

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 392.0927701
Formal Charge 0
FSP3 0.09
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey UNORTDWKWDXNRD-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 119.67
Topological Polar Surface Area 64.36
Polarizability 42.87
Ring Count 4
Rotatable Bond Count 4

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H17ClN2O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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