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N-[4-(4-methylpiperidin-1-yl)-3-(trifluoromethyl)phenyl]-4-(morpholin-4-ylmethyl)benzamide

N-[4-(4-methylpiperidin-1-yl)-3-(trifluoromethyl)phenyl]-4-(morpholin-4-ylmethyl)benzamide

Formula: C25H30F3N3O2

SMILES: CC1CCN(CC1)C1=CC=C(NC(=O)C2=CC=C(CN3CCOCC3)C=C2)C=C1C(F)(F)F

IUPAC: N-[4-(4-methylpiperidin-1-yl)-3-(trifluoromethyl)phenyl]-4-[(morpholin-4-yl)methyl]benzamide

InChI: InChI=1S/C25H30F3N3O2/c1-18-8-10-31(11-9-18)23-7-6-21(16-22(23)25(26,27)28)29-24(32)20-4-2-19(3-5-20)17-30-12-14-33-15-13-30/h2-7,16,18H,8-15,17H2,1H3,(H,29,32)

Composition: C (65.06%), H (6.55%), F (12.35%), N (9.10%), O (6.93%)

Molar Mass: 461.529

Atom Count: 63

Heavy Atom Count: 33

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 461.229011707
Formal Charge 0
FSP3 0.48
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey VVJSZYWIEBDKTC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 126.3
Topological Polar Surface Area 44.81
Polarizability 46.07
Ring Count 4
Rotatable Bond Count 6

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98% <10 Days C25H30F3N3O2 Quote Only
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Purity LeadTime Formula PacketSize UnitPrice
97% <5 Days C25H30F3N3O2 $22.70-$228.24$22.70$54.22$79.44$136.19$228.24
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Molnova Chemicals
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Purity LeadTime Formula PacketSize UnitPrice
98% <4 Days C25H30F3N3O2 $278.75-$1,053.01$278.75$465.50$687.68$1,053.01
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