V007-0119 Screening compound: 5-[4-(4-fluoro-3-methylbenzamido)-2-[(2-methylpropyl)sulfamoyl]phenoxy]-1-methyl-1H-pyrazole-3-carboxylic acid

V007-0119 Screening compound: 5-[4-(4-fluoro-3-methylbenzamido)-2-[(2-methylpropyl)sulfamoyl]phenoxy]-1-methyl-1H-pyrazole-3-carboxylic acid
V007-0119 Screening compound: 5-[4-(4-fluoro-3-methylbenzamido)-2-[(2-methylpropyl)sulfamoyl]phenoxy]-1-methyl-1H-pyrazole-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-0119
5-[4-(4-fluoro-3-methylbenzamido)-2-[(2-methylpropyl)sulfamoyl]phenoxy]-1-methyl-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

V007-0119

Molecular Formula

C23H25FN4O6S (C23 H25 FN4 O6 S)

Compound Name

5-[4-(4-fluoro-3-methylbenzamido)-2-[(2-methylpropyl)sulfamoyl]phenoxy]-1-methyl-1H-pyrazole-3-carboxylic acid

IUPAC name

5-[4-(4-fluoro-3-methylbenzamido)-2-[(2-methylpropyl)sulfamoyl]phenoxy]-1-methyl-1H-pyrazole-3-carboxylic acid

SMILES

CC(C)CNS(c(cc(cc1)NC(c(cc2)cc(C)c2F)=O)c1Oc1cc(C(O)=O)nn1C)(=O)=O

InChI

InChI=1S/C23H25FN4O6S/c1-13(2)12-25-35(32,33)20-10-16(26-22(29)15-5-7-17(24)14(3)9-15)6-8-19(20)34-21-11-18(23(30)31)27-28(21)4/h5-11,13,25H,12H2,1-4H3,(H,26,29)(H,30,31)

InChI Key

YMZHDVPSSFKGNO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19789795

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

504.54

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.257

Distribution Coefficient, logD

0.521

Water Solubility, LogSw

-3.61

Polar Surface Area

114.518

Acid Dissociation Constant (pKa)

4.66

Base Dissociation Constant (pKb)

-2.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

V007-0119 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V007-0119 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-0119?
Check Price and Availability of V007-0119, 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 V007-0119 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-0119
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-0119
  • 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 V007-0119 available by request