V029-9774 Screening compound: 1-(4-methoxyphenyl)-4-methyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide

V029-9774 Screening compound: 1-(4-methoxyphenyl)-4-methyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide
V029-9774 Screening compound: 1-(4-methoxyphenyl)-4-methyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-9774
1-(4-methoxyphenyl)-4-methyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide

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

V029-9774

Molecular Formula

C29H28F3N5O7S (C29 H28 F3 N5 O7 S)

Compound Name

1-(4-methoxyphenyl)-4-methyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide

IUPAC name

1-(4-methoxyphenyl)-4-methyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide

SMILES

CCCNS(c(cc(cc1)[N+]([O-])=O)c1Oc1c(C)c(C(NCc2cc(C(F)(F)F)ccc2)=O)nn1-c(cc1)ccc1OC)(=O)=O

InChI

InChI=1S/C29H28F3N5O7S/c1-4-14-34-45(41,42)25-16-22(37(39)40)10-13-24(25)44-28-18(2)26(35-36(28)21-8-11-23(43-3)12-9-21)27(38)33-17-19-6-5-7-20(15-19)29(30,31)32/h5-13,15-16,34H,4,14,17H2,1-3H3,(H,33,38)

InChI Key

RQVDVKABCMDIPM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19787243

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

647.63

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

5.865

Distribution Coefficient, logD

5.865

Water Solubility, LogSw

-5.63

Polar Surface Area

128.410

Acid Dissociation Constant (pKa)

10.80

Base Dissociation Constant (pKb)

-3.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.10

References: we are preparing a list of scientific research reports with V029-9774 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-9774?
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What is the minimum amount of V029-9774 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-9774
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-9774
  • 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 V029-9774 available by request