V031-1505 Screening compound: 1-[3-(2,5-dimethylphenyl)-5-(3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-methylpiperidin-1-yl)ethan-1-one

V031-1505 Screening compound: 1-[3-(2,5-dimethylphenyl)-5-(3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-methylpiperidin-1-yl)ethan-1-one
V031-1505 Screening compound: 1-[3-(2,5-dimethylphenyl)-5-(3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-methylpiperidin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-1505
1-[3-(2,5-dimethylphenyl)-5-(3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-methylpiperidin-1-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

V031-1505

Molecular Formula

C26H33N3O2 (C26 H33 N3 O2)

Compound Name

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

IUPAC name

1-[3-(25-dimethylphenyl)-5-(3-methoxyphenyl)-45-dihydro-1H-pyrazol-1-yl]-2-(4-methylpiperidin-1-yl)ethan-1-one

SMILES

CC1CCN(CC(N(C(C2)c3cc(OC)ccc3)N=C2c2c(C)ccc(C)c2)=O)CC1

InChI

InChI=1S/C26H33N3O2/c1-18-10-12-28(13-11-18)17-26(30)29-25(21-6-5-7-22(15-21)31-4)16-24(27-29)23-14-19(2)8-9-20(23)3/h5-9,14-15,18,25H,10-13,16-17H2,1-4H3/t25-/m0/s1

InChI Key

NKGAXBBPTQANGQ-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19887255

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

419.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.211

Distribution Coefficient, logD

5.030

Water Solubility, LogSw

-4.99

Polar Surface Area

38.135

Acid Dissociation Constant (pKa)

19.12

Base Dissociation Constant (pKb)

7.11

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.15

References: we are preparing a list of scientific research reports with V031-1505 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-1505?
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What is the minimum amount of V031-1505 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-1505
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-1505
  • 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 V031-1505 available by request