V022-9137 Screening compound: [2-hydroxy-3-(prop-2-yn-1-yloxy)propyl](2-methoxyethyl){[5-(4-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}amine

V022-9137 Screening compound: [2-hydroxy-3-(prop-2-yn-1-yloxy)propyl](2-methoxyethyl){[5-(4-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}amine
V022-9137 Screening compound: [2-hydroxy-3-(prop-2-yn-1-yloxy)propyl](2-methoxyethyl){[5-(4-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-9137
[2-hydroxy-3-(prop-2-yn-1-yloxy)propyl](2-methoxyethyl){[5-(4-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}amine

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

V022-9137

Molecular Formula

C27H33N3O5 (C27 H33 N3 O5)

Compound Name

[2-hydroxy-3-(prop-2-yn-1-yloxy)propyl](2-methoxyethyl){[5-(4-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}amine

IUPAC name

[2-hydroxy-3-(prop-2-yn-1-yloxy)propyl](2-methoxyethyl){[5-(4-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}amine

SMILES

Cn(c(Oc(cc1)ccc1OC)c1CN(CCOC)CC(COCC#C)O)nc1-c1ccccc1

InChI

InChI=1S/C27H33N3O5/c1-5-16-34-20-22(31)18-30(15-17-32-3)19-25-26(21-9-7-6-8-10-21)28-29(2)27(25)35-24-13-11-23(33-4)12-14-24/h1,6-14,22,31H,15-20H2,2-4H3/t22-/m0/s1

InChI Key

NIVSHJCGUICLEQ-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19881734

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

479.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.025

Distribution Coefficient, logD

2.139

Water Solubility, LogSw

-3.12

Polar Surface Area

66.084

Acid Dissociation Constant (pKa)

14.70

Base Dissociation Constant (pKb)

8.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.00

V022-9137 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V022-9137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-9137?
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What is the minimum amount of V022-9137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-9137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-9137
  • 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 V022-9137 available by request