V028-1587 Screening compound: 5-[2-(cyclopropylsulfamoyl)-4-(2-methylbutanamido)phenoxy]-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid

V028-1587 Screening compound: 5-[2-(cyclopropylsulfamoyl)-4-(2-methylbutanamido)phenoxy]-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid
V028-1587 Screening compound: 5-[2-(cyclopropylsulfamoyl)-4-(2-methylbutanamido)phenoxy]-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-1587
5-[2-(cyclopropylsulfamoyl)-4-(2-methylbutanamido)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

V028-1587

Molecular Formula

C25H28N4O6S (C25 H28 N4 O6 S)

Compound Name

5-[2-(cyclopropylsulfamoyl)-4-(2-methylbutanamido)phenoxy]-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid

IUPAC name

5-[2-(cyclopropylsulfamoyl)-4-(2-methylbutanamido)phenoxy]-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid

SMILES

CCC(C)C(Nc(cc1)cc(S(NC2CC2)(=O)=O)c1Oc1c(C)c(C(O)=O)nn1-c1ccccc1)=O

InChI

InChI=1S/C25H28N4O6S/c1-4-15(2)23(30)26-18-12-13-20(21(14-18)36(33,34)28-17-10-11-17)35-24-16(3)22(25(31)32)27-29(24)19-8-6-5-7-9-19/h5-9,12-15,17,28H,4,10-11H2,1-3H3,(H,26,30)(H,31,32)/t15-/m0/s1

InChI Key

LFQPGHXLZAULEA-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD19788835

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

512.59

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.514

Distribution Coefficient, logD

-1.002

Water Solubility, LogSw

-3.88

Polar Surface Area

114.999

Acid Dissociation Constant (pKa)

2.88

Base Dissociation Constant (pKb)

-0.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.00

V028-1587 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V028-1587 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-1587?
Check Price and Availability of V028-1587, 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 V028-1587 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-1587
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-1587
  • 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 V028-1587 available by request