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methyl 3-[5-(phenylcarbamoyl)furan-2-yl]thiophene-2-carboxylate

methyl 3-[5-(phenylcarbamoyl)furan-2-yl]thiophene-2-carboxylate

CAS: 241488-22-2

Formula: C17H13NO4S

SMILES: COC(=O)C1=C(C=CS1)C1=CC=C(O1)C(=O)NC1=CC=CC=C1

IUPAC: methyl 3-[5-(phenylcarbamoyl)furan-2-yl]thiophene-2-carboxylate

InChI: InChI=1S/C17H13NO4S/c1-21-17(20)15-12(9-10-23-15)13-7-8-14(22-13)16(19)18-11-5-3-2-4-6-11/h2-10H,1H3,(H,18,19)

Composition: C (62.37%), H (4.00%), N (4.28%), O (19.55%), S (9.79%)

Molar Mass: 327.35

Atom Count: 36

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 327.056529077
Formal Charge 0
FSP3 0.06
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey RLESMLWWGMYSAV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 87.91
Topological Polar Surface Area 68.54
Polarizability 33.88
Ring Count 3
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 241488-22-2 $51.35-$524.40$51.35$63.37$86.31$524.40
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