V010-2588 Screening compound: 1-(3,4-dichlorophenyl)-3-ethyl-4-[1-isobutyl-2,5-dioxo-4-(1-pyridiniumyl)-2,5-dihydro-1H-pyrrol-3-yl]-1H-pyrazol-5-olate

V010-2588 Screening compound: 1-(3,4-dichlorophenyl)-3-ethyl-4-[1-isobutyl-2,5-dioxo-4-(1-pyridiniumyl)-2,5-dihydro-1H-pyrrol-3-yl]-1H-pyrazol-5-olate
V010-2588 Screening compound: 1-(3,4-dichlorophenyl)-3-ethyl-4-[1-isobutyl-2,5-dioxo-4-(1-pyridiniumyl)-2,5-dihydro-1H-pyrrol-3-yl]-1H-pyrazol-5-olate alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-2588
1-(3,4-dichlorophenyl)-3-ethyl-4-[1-isobutyl-2,5-dioxo-4-(1-pyridiniumyl)-2,5-dihydro-1H-pyrrol-3-yl]-1H-pyrazol-5-olate

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

V010-2588

Molecular Formula

C24H22Cl2N4O3 (C24 H22 Cl2 N4 O3)

Compound Name

1-(3,4-dichlorophenyl)-3-ethyl-4-[1-isobutyl-2,5-dioxo-4-(1-pyridiniumyl)-2,5-dihydro-1H-pyrrol-3-yl]-1H-pyrazol-5-olate

IUPAC name

1-{4-[1-(34-dichlorophenyl)-3-ethyl-5-oxido-1H-pyrazol-4-yl]-1-(2-methylpropyl)-25-dioxo-25-dihydro-1H-pyrrol-3-yl}-1lambda5-pyridin-1-ylium

SMILES

CCc(c(C(C(N(CC(C)C)C1=O)=O)=C1[n+]1ccccc1)c1[O-])nn1-c(cc1)cc(Cl)c1Cl

InChI

InChI=1S/C24H22Cl2N4O3/c1-4-18-19(23(32)30(27-18)15-8-9-16(25)17(26)12-15)20-21(28-10-6-5-7-11-28)24(33)29(22(20)31)13-14(2)3/h5-12,14H,4,13H2,1-3H3

InChI Key

WABUHFYGPOJIQQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19722032

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

485.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.416

Distribution Coefficient, logD

4.416

Water Solubility, LogSw

-4.35

Polar Surface Area

63.187

Acid Dissociation Constant (pKa)

25.60

Base Dissociation Constant (pKb)

-8.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with V010-2588 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-2588?
Check Price and Availability of V010-2588, 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 V010-2588 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-2588
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-2588
  • 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 V010-2588 available by request