V027-0941 Screening compound: 2-[butyl({[3-(trifluoromethyl)phenyl]carbamoyl})amino]-N-[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]acetamide

V027-0941 Screening compound: 2-[butyl({[3-(trifluoromethyl)phenyl]carbamoyl})amino]-N-[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]acetamide
V027-0941 Screening compound: 2-[butyl({[3-(trifluoromethyl)phenyl]carbamoyl})amino]-N-[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-0941
2-[butyl({[3-(trifluoromethyl)phenyl]carbamoyl})amino]-N-[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]acetamide

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

V027-0941

Molecular Formula

C31H32F3N5O3 (C31 H32 F3 N5 O3)

Compound Name

2-[butyl({[3-(trifluoromethyl)phenyl]carbamoyl})amino]-N-[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]acetamide

IUPAC name

2-[butyl({[3-(trifluoromethyl)phenyl]carbamoyl})amino]-N-[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]acetamide

SMILES

CCCCN(CC(Nc(n(-c(cc1)ccc1OC)nc1C)c1-c1ccccc1)=O)C(Nc1cccc(C(F)(F)F)c1)=O

InChI

InChI=1S/C31H32F3N5O3/c1-4-5-18-38(30(41)35-24-13-9-12-23(19-24)31(32,33)34)20-27(40)36-29-28(22-10-7-6-8-11-22)21(2)37-39(29)25-14-16-26(42-3)17-15-25/h6-17,19H,4-5,18,20H2,1-3H3,(H,35,41)(H,36,40)

InChI Key

KCAJKTYEUZJWNV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19715932

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

579.62

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.666

Distribution Coefficient, logD

6.666

Water Solubility, LogSw

-5.72

Polar Surface Area

69.760

Acid Dissociation Constant (pKa)

11.63

Base Dissociation Constant (pKb)

0.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.80

V027-0941 in Drug Discovery

Included in Screening Libraries

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V027-0941 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-0941?
Check Price and Availability of V027-0941, 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 V027-0941 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-0941
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-0941
  • 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 V027-0941 available by request