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3,4-dichloro-N-[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]benzamide

3,4-dichloro-N-[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]benzamide

Formula: C21H14Cl2N2O2

SMILES: CC1=CC=CC=C1C1=NC2=CC(NC(=O)C3=CC=C(Cl)C(Cl)=C3)=CC=C2O1

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

InChI: InChI=1S/C21H14Cl2N2O2/c1-12-4-2-3-5-15(12)21-25-18-11-14(7-9-19(18)27-21)24-20(26)13-6-8-16(22)17(23)10-13/h2-11H,1H3,(H,24,26)

Composition: C (63.49%), H (3.55%), Cl (17.85%), N (7.05%), O (8.05%)

Molar Mass: 397.26

Atom Count: 41

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 396.0432331
Formal Charge 0
FSP3 0.05
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey RFLRJXOSZBYFCE-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 118.01
Topological Polar Surface Area 55.13
Polarizability 42.23
Ring Count 4
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H14Cl2N2O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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