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ethyl 2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxylate

ethyl 2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxylate

CAS: 232596-43-9

Formula: C11H11N3O2S

SMILES: CCOC(=O)C1=CSC(NC2=NC=CC=C2)=N1

IUPAC: ethyl 2-[(pyridin-2-yl)amino]-1,3-thiazole-4-carboxylate

InChI: InChI=1S/C11H11N3O2S/c1-2-16-10(15)8-7-17-11(13-8)14-9-5-3-4-6-12-9/h3-7H,2H2,1H3,(H,12,13,14)

Composition: C (53.00%), H (4.45%), N (16.86%), O (12.84%), S (12.86%)

Molar Mass: 249.29

Atom Count: 28

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 249.05719778
Formal Charge 0
FSP3 0.18
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey OJLOWWJZAOEGDR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.78
Topological Polar Surface Area 64.11
Polarizability 24.28
Ring Count 2
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 232596-43-9 $51.35-$86.31$51.35$63.37$86.31
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