V029-4590 Screening compound: 1-(2,5-dimethylphenyl)-5-[4-(3-fluorobenzamido)-2-[(propan-2-yl)sulfamoyl]phenoxy]-4-methyl-1H-pyrazole-3-carboxylic acid

V029-4590 Screening compound: 1-(2,5-dimethylphenyl)-5-[4-(3-fluorobenzamido)-2-[(propan-2-yl)sulfamoyl]phenoxy]-4-methyl-1H-pyrazole-3-carboxylic acid
V029-4590 Screening compound: 1-(2,5-dimethylphenyl)-5-[4-(3-fluorobenzamido)-2-[(propan-2-yl)sulfamoyl]phenoxy]-4-methyl-1H-pyrazole-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-4590
1-(2,5-dimethylphenyl)-5-[4-(3-fluorobenzamido)-2-[(propan-2-yl)sulfamoyl]phenoxy]-4-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

V029-4590

Molecular Formula

C29H29FN4O6S (C29 H29 FN4 O6 S)

Compound Name

1-(2,5-dimethylphenyl)-5-[4-(3-fluorobenzamido)-2-[(propan-2-yl)sulfamoyl]phenoxy]-4-methyl-1H-pyrazole-3-carboxylic acid

IUPAC name

1-(25-dimethylphenyl)-5-[4-(3-fluorobenzamido)-2-[(propan-2-yl)sulfamoyl]phenoxy]-4-methyl-1H-pyrazole-3-carboxylic acid

SMILES

CC(C)NS(c(cc(cc1)NC(c2cc(F)ccc2)=O)c1Oc1c(C)c(C(O)=O)nn1-c1c(C)ccc(C)c1)(=O)=O

InChI

InChI=1S/C29H29FN4O6S/c1-16(2)33-41(38,39)25-15-22(31-27(35)20-7-6-8-21(30)14-20)11-12-24(25)40-28-19(5)26(29(36)37)32-34(28)23-13-17(3)9-10-18(23)4/h6-16,33H,1-5H3,(H,31,35)(H,36,37)

InChI Key

VKAOHJVUQRZSBX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19786913

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

580.64

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

5.219

Distribution Coefficient, logD

0.703

Water Solubility, LogSw

-4.95

Polar Surface Area

113.616

Acid Dissociation Constant (pKa)

2.88

Base Dissociation Constant (pKb)

-2.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.70

V029-4590 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with V029-4590 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-4590?
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What is the minimum amount of V029-4590 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-4590
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-4590
  • 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 V029-4590 available by request