V018-8627 Screening compound: [3-(benzyloxy)-2-hydroxypropyl]({[3-methyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})propylamine

V018-8627 Screening compound: [3-(benzyloxy)-2-hydroxypropyl]({[3-methyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})propylamine
V018-8627 Screening compound: [3-(benzyloxy)-2-hydroxypropyl]({[3-methyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})propylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-8627
[3-(benzyloxy)-2-hydroxypropyl]({[3-methyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})propylamine

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

V018-8627

Molecular Formula

C31H37N3O3 (C31 H37 N3 O3)

Compound Name

[3-(benzyloxy)-2-hydroxypropyl]({[3-methyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})propylamine

IUPAC name

[3-(benzyloxy)-2-hydroxypropyl]({[3-methyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})propylamine

SMILES

CCCN(CC(COCc1ccccc1)O)Cc(c(C)nn1-c2ccccc2)c1Oc1ccc(C)cc1

InChI

InChI=1S/C31H37N3O3/c1-4-19-33(20-28(35)23-36-22-26-11-7-5-8-12-26)21-30-25(3)32-34(27-13-9-6-10-14-27)31(30)37-29-17-15-24(2)16-18-29/h5-18,28,35H,4,19-23H2,1-3H3/t28-/m0/s1

InChI Key

NJYNMSBGHMGZIV-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD19887360

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

499.65

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

6.004

Distribution Coefficient, logD

4.208

Water Solubility, LogSw

-5.65

Polar Surface Area

49.664

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

9.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.30

References: we are preparing a list of scientific research reports with V018-8627 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-8627?
Check Price and Availability of V018-8627, 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 V018-8627 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-8627
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-8627
  • 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 V018-8627 available by request