V022-9239 Screening compound: N-(3-butoxy-2-hydroxypropyl)-N-{[3-methyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}cyclopropanamine

V022-9239 Screening compound: N-(3-butoxy-2-hydroxypropyl)-N-{[3-methyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}cyclopropanamine
V022-9239 Screening compound: N-(3-butoxy-2-hydroxypropyl)-N-{[3-methyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}cyclopropanamine alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-9239
N-(3-butoxy-2-hydroxypropyl)-N-{[3-methyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}cyclopropanamine

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

V022-9239

Molecular Formula

C28H37N3O3 (C28 H37 N3 O3)

Compound Name

N-(3-butoxy-2-hydroxypropyl)-N-{[3-methyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}cyclopropanamine

IUPAC name

N-(3-butoxy-2-hydroxypropyl)-N-{[3-methyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}cyclopropanamine

SMILES

CCCCOCC(CN(Cc(c(C)nn1-c2ccccc2)c1Oc1ccc(C)cc1)C1CC1)O

InChI

InChI=1S/C28H37N3O3/c1-4-5-17-33-20-25(32)18-30(23-13-14-23)19-27-22(3)29-31(24-9-7-6-8-10-24)28(27)34-26-15-11-21(2)12-16-26/h6-12,15-16,23,25,32H,4-5,13-14,17-20H2,1-3H3/t25-/m0/s1

InChI Key

IBMAKHMOCDKAMW-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19887343

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

463.62

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.431

Distribution Coefficient, logD

4.759

Water Solubility, LogSw

-5.28

Polar Surface Area

49.072

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

7.97

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.40

References: we are preparing a list of scientific research reports with V022-9239 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-9239?
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What is the minimum amount of V022-9239 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-9239
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-9239
  • 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 V022-9239 available by request