V021-8827 Screening compound: 1-({[5-(2-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}(cyclopropyl)amino)hex-5-en-2-ol

V021-8827 Screening compound: 1-({[5-(2-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}(cyclopropyl)amino)hex-5-en-2-ol
V021-8827 Screening compound: 1-({[5-(2-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}(cyclopropyl)amino)hex-5-en-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-8827
1-({[5-(2-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}(cyclopropyl)amino)hex-5-en-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

V021-8827

Molecular Formula

C26H30ClN3O2 (C26 H30 ClN3 O2)

Compound Name

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

IUPAC name

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

SMILES

Cn(c(Oc(cccc1)c1Cl)c1CN(CC(CCC=C)O)C2CC2)nc1-c1ccccc1

InChI

InChI=1S/C26H30ClN3O2/c1-3-4-12-21(31)17-30(20-15-16-20)18-22-25(19-10-6-5-7-11-19)28-29(2)26(22)32-24-14-9-8-13-23(24)27/h3,5-11,13-14,20-21,31H,1,4,12,15-18H2,2H3/t21-/m0/s1

InChI Key

KMWHAEQQAIDKKN-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19881538

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

452

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.106

Distribution Coefficient, logD

3.656

Water Solubility, LogSw

-5.49

Polar Surface Area

41.149

Acid Dissociation Constant (pKa)

16.82

Base Dissociation Constant (pKb)

8.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.60

References: we are preparing a list of scientific research reports with V021-8827 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-8827?
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What is the minimum amount of V021-8827 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-8827
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-8827
  • 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 V021-8827 available by request