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2-phenyl-N-(prop-2-en-1-yl)-1,3-thiazole-4-carboxamide

2-phenyl-N-(prop-2-en-1-yl)-1,3-thiazole-4-carboxamide

CAS: 303998-28-9

Formula: C13H12N2OS

SMILES: C=CCNC(=O)C1=CSC(=N1)C1=CC=CC=C1

IUPAC: 2-phenyl-N-(prop-2-en-1-yl)-1,3-thiazole-4-carboxamide

InChI: InChI=1S/C13H12N2OS/c1-2-8-14-12(16)11-9-17-13(15-11)10-6-4-3-5-7-10/h2-7,9H,1,8H2,(H,14,16)

Composition: C (63.91%), H (4.95%), N (11.47%), O (6.55%), S (13.12%)

Molar Mass: 244.31

Atom Count: 29

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 244.067034188
Formal Charge 0
FSP3 0.08
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey HPSJITMHRJUUMB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 79.13
Topological Polar Surface Area 41.99
Polarizability 26.51
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 303998-28-9 $51.35-$86.31$51.35$63.37$86.31
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