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1-(3-chloro-1-benzothiophene-2-carbonyl)-2,6-dimethylpiperidine

1-(3-chloro-1-benzothiophene-2-carbonyl)-2,6-dimethylpiperidine

Formula: C16H18ClNOS

SMILES: CC1CCCC(C)N1C(=O)C1=C(Cl)C2=CC=CC=C2S1

IUPAC: 1-(3-chloro-1-benzothiophene-2-carbonyl)-2,6-dimethylpiperidine

InChI: InChI=1/C16H18ClNOS/c1-10-6-5-7-11(2)18(10)16(19)15-14(17)12-8-3-4-9-13(12)20-15/h3-4,8-11H,5-7H2,1-2H3

Composition: C (62.43%), H (5.89%), Cl (11.52%), N (4.55%), O (5.20%), S (10.41%)

Molar Mass: 307.84

Atom Count: 38

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 2
Exact Mass 307.0797631
Formal Charge 0
FSP3 0.44
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey AJXSXGNXXNXKQD-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 83.84
Topological Polar Surface Area 20.31
Polarizability 33.41
Ring Count 3
Rotatable Bond Count 1

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H18ClNOS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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