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1,3,5-trimethyl-2,6-diphenyl-4-(2-phenylethynyl)piperidin-4-ol

1,3,5-trimethyl-2,6-diphenyl-4-(2-phenylethynyl)piperidin-4-ol

Formula: C28H29NO

SMILES: CC1C(N(C)C(C(C)C1(O)C#CC1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1

IUPAC: 1,3,5-trimethyl-2,6-diphenyl-4-(2-phenylethynyl)piperidin-4-ol

InChI: InChI=1/C28H29NO/c1-21-26(24-15-9-5-10-16-24)29(3)27(25-17-11-6-12-18-25)22(2)28(21,30)20-19-23-13-7-4-8-14-23/h4-18,21-22,26-27,30H,1-3H3

Composition: C (85.02%), H (7.39%), N (3.54%), O (4.04%)

Molar Mass: 395.546

Atom Count: 59

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 4
Exact Mass 395.224914558
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey HMVLFUWQWMPWKQ-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 121.24
Topological Polar Surface Area 23.47
Polarizability 48.35
Ring Count 4
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C28H29NO $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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