V011-3453 Screening compound: {[5-(4-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}[2-hydroxy-3-(prop-2-en-1-yloxy)propyl](2-methoxyethyl)amine

V011-3453 Screening compound: {[5-(4-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}[2-hydroxy-3-(prop-2-en-1-yloxy)propyl](2-methoxyethyl)amine
V011-3453 Screening compound: {[5-(4-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}[2-hydroxy-3-(prop-2-en-1-yloxy)propyl](2-methoxyethyl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-3453
{[5-(4-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}[2-hydroxy-3-(prop-2-en-1-yloxy)propyl](2-methoxyethyl)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

V011-3453

Molecular Formula

C26H32ClN3O4 (C26 H32 ClN3 O4)

Compound Name

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

IUPAC name

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

SMILES

Cc(c(CN(CCOC)CC(COCC=C)O)c1Oc(cc2)ccc2Cl)nn1-c1ccccc1

InChI

InChI=1S/C26H32ClN3O4/c1-4-15-33-19-23(31)17-29(14-16-32-3)18-25-20(2)28-30(22-8-6-5-7-9-22)26(25)34-24-12-10-21(27)11-13-24/h4-13,23,31H,1,14-19H2,2-3H3/t23-/m0/s1

InChI Key

JHFRZGOUIDOGIP-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19881282

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

486.01

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.210

Distribution Coefficient, logD

3.354

Water Solubility, LogSw

-4.31

Polar Surface Area

58.197

Acid Dissociation Constant (pKa)

14.70

Base Dissociation Constant (pKb)

8.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.60

V011-3453 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V011-3453 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-3453?
Check Price and Availability of V011-3453, 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 V011-3453 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-3453
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-3453
  • 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 V011-3453 available by request