V026-9449 Screening compound: 1-[cyclopropyl({[3-methyl-5-(3-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})amino]butan-2-ol

V026-9449 Screening compound: 1-[cyclopropyl({[3-methyl-5-(3-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})amino]butan-2-ol
V026-9449 Screening compound: 1-[cyclopropyl({[3-methyl-5-(3-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})amino]butan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-9449
1-[cyclopropyl({[3-methyl-5-(3-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})amino]butan-2-ol

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

V026-9449

Molecular Formula

C25H31N3O2 (C25 H31 N3 O2)

Compound Name

1-[cyclopropyl({[3-methyl-5-(3-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})amino]butan-2-ol

IUPAC name

1-[cyclopropyl({[3-methyl-5-(3-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})amino]butan-2-ol

SMILES

CCC(CN(Cc(c(C)nn1-c2ccccc2)c1Oc1cc(C)ccc1)C1CC1)O

InChI

InChI=1S/C25H31N3O2/c1-4-22(29)16-27(20-13-14-20)17-24-19(3)26-28(21-10-6-5-7-11-21)25(24)30-23-12-8-9-18(2)15-23/h5-12,15,20,22,29H,4,13-14,16-17H2,1-3H3/t22-/m0/s1

InChI Key

YJVDZCZNFLBVBA-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19881499

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

405.54

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.867

Distribution Coefficient, logD

3.877

Water Solubility, LogSw

-4.69

Polar Surface Area

40.719

Acid Dissociation Constant (pKa)

16.77

Base Dissociation Constant (pKb)

8.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

V026-9449 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system

References: we are preparing a list of scientific research reports with V026-9449 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-9449?
Check Price and Availability of V026-9449, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V026-9449 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-9449
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-9449
  • 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 V026-9449 available by request