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4-chloro-N-{[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]methyl}benzamide

4-chloro-N-{[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]methyl}benzamide

CAS: 865658-39-5

Formula: C18H14Cl2N2OS

SMILES: CC1=C(CNC(=O)C2=CC=C(Cl)C=C2)SC(=N1)C1=CC=C(Cl)C=C1

IUPAC: 4-chloro-N-{[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]methyl}benzamide

InChI: InChI=1S/C18H14Cl2N2OS/c1-11-16(10-21-17(23)12-2-6-14(19)7-3-12)24-18(22-11)13-4-8-15(20)9-5-13/h2-9H,10H2,1H3,(H,21,23)

Composition: C (57.30%), H (3.74%), Cl (18.79%), N (7.43%), O (4.24%), S (8.50%)

Molar Mass: 377.28

Atom Count: 38

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 376.0203897
Formal Charge 0
FSP3 0.11
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey HDOHFGICQHEJBX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 108.94
Topological Polar Surface Area 41.99
Polarizability 38.15
Ring Count 3
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 865658-39-5 $51.35-$86.31$51.35$63.37$86.31
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