V022-8608 Screening compound: 1-[3-(2,4-dimethylphenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one

V022-8608 Screening compound: 1-[3-(2,4-dimethylphenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one
V022-8608 Screening compound: 1-[3-(2,4-dimethylphenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-8608
1-[3-(2,4-dimethylphenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-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

V022-8608

Molecular Formula

C29H31N3O (C29 H31 N3 O)

Compound Name

1-[3-(2,4-dimethylphenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one

IUPAC name

1-[3-(24-dimethylphenyl)-5-(4-methylphenyl)-45-dihydro-1H-pyrazol-1-yl]-2-(1234-tetrahydroisoquinolin-2-yl)ethan-1-one

SMILES

Cc1ccc(C(C2)N(C(CN(CC3)Cc4c3cccc4)=O)N=C2c2c(C)cc(C)cc2)cc1

InChI

InChI=1S/C29H31N3O/c1-20-8-11-24(12-9-20)28-17-27(26-13-10-21(2)16-22(26)3)30-32(28)29(33)19-31-15-14-23-6-4-5-7-25(23)18-31/h4-13,16,28H,14-15,17-19H2,1-3H3/t28-/m0/s1

InChI Key

VCYHWWHASLZKCQ-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD19886375

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

437.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.288

Distribution Coefficient, logD

6.278

Water Solubility, LogSw

-5.46

Polar Surface Area

30.253

Acid Dissociation Constant (pKa)

19.12

Base Dissociation Constant (pKb)

5.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.00

References: we are preparing a list of scientific research reports with V022-8608 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-8608?
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What is the minimum amount of V022-8608 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-8608
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-8608
  • 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 V022-8608 available by request