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N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]benzamide

N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]benzamide

CAS: 313553-47-8

Formula: C18H16N2OS

SMILES: CC1=CC(C)=C(C=C1)C1=CSC(NC(=O)C2=CC=CC=C2)=N1

IUPAC: N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]benzamide

InChI: InChI=1S/C18H16N2OS/c1-12-8-9-15(13(2)10-12)16-11-22-18(19-16)20-17(21)14-6-4-3-5-7-14/h3-11H,1-2H3,(H,19,20,21)

Composition: C (70.10%), H (5.23%), N (9.08%), O (5.19%), S (10.40%)

Molar Mass: 308.4

Atom Count: 38

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 308.098334317
Formal Charge 0
FSP3 0.11
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey JPMOKRWIYQGMJL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 91.12
Topological Polar Surface Area 41.99
Polarizability 35.21
Ring Count 3
Rotatable Bond Count 3

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Selleck Chemicals
Purity LeadTime CAS UnitPrice
98% <10 Days 313553-47-8 Quote Only
Molnova Chemicals
Purity LeadTime CAS PacketSize UnitPrice
98% <4 Days 313553-47-8 $22.93-$351.62$22.93$32.10$40.51$69.56$126.89$220.15$351.62
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