V003-3751 Screening compound: 5-{4-cyclopropaneamido-2-[(4-ethylpiperazin-1-yl)sulfonyl]phenoxy}-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid

V003-3751 Screening compound: 5-{4-cyclopropaneamido-2-[(4-ethylpiperazin-1-yl)sulfonyl]phenoxy}-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid
V003-3751 Screening compound: 5-{4-cyclopropaneamido-2-[(4-ethylpiperazin-1-yl)sulfonyl]phenoxy}-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-3751
5-{4-cyclopropaneamido-2-[(4-ethylpiperazin-1-yl)sulfonyl]phenoxy}-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid

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

V003-3751

Molecular Formula

C27H31N5O6S (C27 H31 N5 O6 S)

Compound Name

5-{4-cyclopropaneamido-2-[(4-ethylpiperazin-1-yl)sulfonyl]phenoxy}-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid

IUPAC name

5-{4-cyclopropaneamido-2-[(4-ethylpiperazin-1-yl)sulfonyl]phenoxy}-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid

SMILES

CCN(CC1)CCN1S(c(cc(cc1)NC(C2CC2)=O)c1Oc1c(C)c(C(O)=O)nn1-c1ccccc1)(=O)=O

InChI

InChI=1S/C27H31N5O6S/c1-3-30-13-15-31(16-14-30)39(36,37)23-17-20(28-25(33)19-9-10-19)11-12-22(23)38-26-18(2)24(27(34)35)29-32(26)21-7-5-4-6-8-21/h4-8,11-12,17,19H,3,9-10,13-16H2,1-2H3,(H,28,33)(H,34,35)

InChI Key

BTNYTMKCIBSQRL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19792031

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

553.64

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.807

Distribution Coefficient, logD

-1.709

Water Solubility, LogSw

-3.41

Polar Surface Area

108.471

Acid Dissociation Constant (pKa)

2.88

Base Dissociation Constant (pKb)

6.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.00

V003-3751 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V003-3751 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-3751?
Check Price and Availability of V003-3751, 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 V003-3751 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-3751
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-3751
  • 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 V003-3751 available by request