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4-{5-[(2S)-pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl}pyridine dihydrochloride

4-{5-[(2S)-pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl}pyridine dihydrochloride

CAS: 1609388-48-8

Formula: C11H14Cl2N4O

SMILES: Cl.Cl.C1CN[C@@H](C1)C1=NC(=NO1)C1=CC=NC=C1

IUPAC: 4-{5-[(2S)-pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl}pyridine dihydrochloride

InChI: InChI=1S/C11H12N4O.2ClH/c1-2-9(13-5-1)11-14-10(15-16-11)8-3-6-12-7-4-8;;/h3-4,6-7,9,13H,1-2,5H2;2*1H/t9-;;/m0../s1

Composition: C (45.69%), H (4.88%), Cl (24.52%), N (19.38%), O (5.53%)

Molar Mass: 289.16

Atom Count: 32

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 288.0544665
Formal Charge 0
FSP3 0.36
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey FRLRQVMGYGXONE-WWPIYYJJSA-N
Lipinski's Rule of Five 1
Molar Refractivity 69.79
Topological Polar Surface Area 63.84
Polarizability 22.98
Ring Count 3
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
95% <4 Days 1609388-48-8 $28.75-$1,189.10$28.75$116.15$297.85$1,189.10
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