C151-0320 Screening compound: (3Z,5Z)-1-(propan-2-yl)-3,5-bis({[4-(trifluoromethyl)phenyl]methylidene})piperidin-4-one

C151-0320 Screening compound: (3Z,5Z)-1-(propan-2-yl)-3,5-bis({[4-(trifluoromethyl)phenyl]methylidene})piperidin-4-one
C151-0320 Screening compound: (3Z,5Z)-1-(propan-2-yl)-3,5-bis({[4-(trifluoromethyl)phenyl]methylidene})piperidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C151-0320
(3Z,5Z)-1-(propan-2-yl)-3,5-bis({[4-(trifluoromethyl)phenyl]methylidene})piperidin-4-one

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

C151-0320

Molecular Formula

C24H21F6NO (C24 H21 F6 NO)

Compound Name

(3Z,5Z)-1-(propan-2-yl)-3,5-bis({[4-(trifluoromethyl)phenyl]methylidene})piperidin-4-one

IUPAC name

(3Z5Z)-1-(propan-2-yl)-35-bis({[4-(trifluoromethyl)phenyl]methylidene})piperidin-4-one

SMILES

CC(C)N(C/C(/C1=O)=C/c2ccc(C(F)(F)F)cc2)C/C1=C/c1ccc(C(F)(F)F)cc1

InChI

InChI=1S/C24H21F6NO/c1-15(2)31-13-18(11-16-3-7-20(8-4-16)23(25,26)27)22(32)19(14-31)12-17-5-9-21(10-6-17)24(28,29)30/h3-12,15H,13-14H2,1-2H3

InChI Key

CPVUAFYTOSZEJK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03829020

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

6.474

Distribution Coefficient, logD

6.472

Water Solubility, LogSw

-5.82

Polar Surface Area

16.765

Acid Dissociation Constant (pKa)

27.88

Base Dissociation Constant (pKb)

4.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

C151-0320 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C151-0320 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C151-0320?
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What is the minimum amount of C151-0320 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C151-0320
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C151-0320
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of C151-0320 available by request