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1-[1-(thiophen-2-ylmethyl)piperidine-3-carbonyl]azepane

1-[1-(thiophen-2-ylmethyl)piperidine-3-carbonyl]azepane

Formula: C17H26N2OS

SMILES: O=C(C1CCCN(CC2=CC=CS2)C1)N1CCCCCC1

IUPAC: 1-{1-[(thiophen-2-yl)methyl]piperidine-3-carbonyl}azepane

InChI: InChI=1/C17H26N2OS/c20-17(19-10-3-1-2-4-11-19)15-7-5-9-18(13-15)14-16-8-6-12-21-16/h6,8,12,15H,1-5,7,9-11,13-14H2

Composition: C (66.63%), H (8.55%), N (9.14%), O (5.22%), S (10.46%)

Molar Mass: 306.47

Atom Count: 47

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 306.176584639
Formal Charge 0
FSP3 0.71
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey GOYOCCTUHHVZNJ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 88.08
Topological Polar Surface Area 23.55
Polarizability 34.19
Ring Count 3
Rotatable Bond Count 3

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H26N2OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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