V029-4999 Screening compound: 1-tert-butyl-4-methyl-5-[4-(2-methylpropanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy]-1H-pyrazole-3-carboxylic acid

V029-4999 Screening compound: 1-tert-butyl-4-methyl-5-[4-(2-methylpropanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy]-1H-pyrazole-3-carboxylic acid
V029-4999 Screening compound: 1-tert-butyl-4-methyl-5-[4-(2-methylpropanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy]-1H-pyrazole-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-4999
1-tert-butyl-4-methyl-5-[4-(2-methylpropanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy]-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

V029-4999

Molecular Formula

C22H32N4O6S (C22 H32 N4 O6 S)

Compound Name

1-tert-butyl-4-methyl-5-[4-(2-methylpropanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy]-1H-pyrazole-3-carboxylic acid

IUPAC name

1-tert-butyl-4-methyl-5-[4-(2-methylpropanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy]-1H-pyrazole-3-carboxylic acid

SMILES

CC(C)C(Nc(cc1)cc(S(NC(C)C)(=O)=O)c1Oc1c(C)c(C(O)=O)nn1C(C)(C)C)=O

InChI

InChI=1S/C22H32N4O6S/c1-12(2)19(27)23-15-9-10-16(17(11-15)33(30,31)25-13(3)4)32-20-14(5)18(21(28)29)24-26(20)22(6,7)8/h9-13,25H,1-8H3,(H,23,27)(H,28,29)

InChI Key

IDKSBBVAUCHWBG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19786235

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

480.59

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

2.926

Distribution Coefficient, logD

0.213

Water Solubility, LogSw

-3.44

Polar Surface Area

115.156

Acid Dissociation Constant (pKa)

4.69

Base Dissociation Constant (pKb)

-0.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with V029-4999 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-4999?
Check Price and Availability of V029-4999, 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 V029-4999 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-4999
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-4999
  • 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 V029-4999 available by request