V027-7810 Screening compound: 5-[2-(tert-butylsulfamoyl)-4-[4-methoxy-3-(trifluoromethyl)benzamido]phenoxy]-1-ethyl-4-methyl-1H-pyrazole-3-carboxylic acid

V027-7810 Screening compound: 5-[2-(tert-butylsulfamoyl)-4-[4-methoxy-3-(trifluoromethyl)benzamido]phenoxy]-1-ethyl-4-methyl-1H-pyrazole-3-carboxylic acid
V027-7810 Screening compound: 5-[2-(tert-butylsulfamoyl)-4-[4-methoxy-3-(trifluoromethyl)benzamido]phenoxy]-1-ethyl-4-methyl-1H-pyrazole-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-7810
5-[2-(tert-butylsulfamoyl)-4-[4-methoxy-3-(trifluoromethyl)benzamido]phenoxy]-1-ethyl-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

V027-7810

Molecular Formula

C26H29F3N4O7S (C26 H29 F3 N4 O7 S)

Compound Name

5-[2-(tert-butylsulfamoyl)-4-[4-methoxy-3-(trifluoromethyl)benzamido]phenoxy]-1-ethyl-4-methyl-1H-pyrazole-3-carboxylic acid

IUPAC name

5-[2-(tert-butylsulfamoyl)-4-[4-methoxy-3-(trifluoromethyl)benzamido]phenoxy]-1-ethyl-4-methyl-1H-pyrazole-3-carboxylic acid

SMILES

CCn1nc(C(O)=O)c(C)c1Oc(ccc(NC(c(cc1)cc(C(F)(F)F)c1OC)=O)c1)c1S(NC(C)(C)C)(=O)=O

InChI

InChI=1S/C26H29F3N4O7S/c1-7-33-23(14(2)21(31-33)24(35)36)40-19-11-9-16(13-20(19)41(37,38)32-25(3,4)5)30-22(34)15-8-10-18(39-6)17(12-15)26(27,28)29/h8-13,32H,7H2,1-6H3,(H,30,34)(H,35,36)

InChI Key

NWDRAUFMCBEOIG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19784192

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

598.6

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

3.780

Distribution Coefficient, logD

1.068

Water Solubility, LogSw

-4.10

Polar Surface Area

121.257

Acid Dissociation Constant (pKa)

4.69

Base Dissociation Constant (pKb)

-2.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

References: we are preparing a list of scientific research reports with V027-7810 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-7810?
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What is the minimum amount of V027-7810 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-7810
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-7810
  • 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 V027-7810 available by request