V030-1797 Screening compound: 1,4-dimethyl-5-{2-[(propan-2-yl)sulfamoyl]-4-(thiophene-2-amido)phenoxy}-1H-pyrazole-3-carboxylic acid

V030-1797 Screening compound: 1,4-dimethyl-5-{2-[(propan-2-yl)sulfamoyl]-4-(thiophene-2-amido)phenoxy}-1H-pyrazole-3-carboxylic acid
V030-1797 Screening compound: 1,4-dimethyl-5-{2-[(propan-2-yl)sulfamoyl]-4-(thiophene-2-amido)phenoxy}-1H-pyrazole-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-1797
1,4-dimethyl-5-{2-[(propan-2-yl)sulfamoyl]-4-(thiophene-2-amido)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

V030-1797

Molecular Formula

C20H22N4O6S2 (C20 H22 N4 O6 S2)

Compound Name

1,4-dimethyl-5-{2-[(propan-2-yl)sulfamoyl]-4-(thiophene-2-amido)phenoxy}-1H-pyrazole-3-carboxylic acid

IUPAC name

14-dimethyl-5-{2-[(propan-2-yl)sulfamoyl]-4-(thiophene-2-amido)phenoxy}-1H-pyrazole-3-carboxylic acid

SMILES

CC(C)NS(c(cc(cc1)NC(c2cccs2)=O)c1Oc1c(C)c(C(O)=O)nn1C)(=O)=O

InChI

InChI=1S/C20H22N4O6S2/c1-11(2)23-32(28,29)16-10-13(21-18(25)15-6-5-9-31-15)7-8-14(16)30-19-12(3)17(20(26)27)22-24(19)4/h5-11,23H,1-4H3,(H,21,25)(H,26,27)

InChI Key

BFLZIYYLWRCVIC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20498003

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

478.55

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.160

Distribution Coefficient, logD

-0.553

Water Solubility, LogSw

-2.98

Polar Surface Area

115.357

Acid Dissociation Constant (pKa)

4.69

Base Dissociation Constant (pKb)

-1.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with V030-1797 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-1797?
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What is the minimum amount of V030-1797 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-1797
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-1797
  • 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 V030-1797 available by request