V003-3399 Screening compound: 2-chloro-N-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}-N-(propan-2-yl)benzamide

V003-3399 Screening compound: 2-chloro-N-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}-N-(propan-2-yl)benzamide
V003-3399 Screening compound: 2-chloro-N-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}-N-(propan-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-3399
2-chloro-N-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}-N-(propan-2-yl)benzamide

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

V003-3399

Molecular Formula

C23H24ClF3N4O (C23 H24 ClF3 N4 O)

Compound Name

2-chloro-N-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}-N-(propan-2-yl)benzamide

IUPAC name

2-chloro-N-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}-N-(propan-2-yl)benzamide

SMILES

CC(C)N(Cc1c(N(C)C)n(-c2ccccc2)nc1C(F)(F)F)C(c(cccc1)c1Cl)=O

InChI

InChI=1S/C23H24ClF3N4O/c1-15(2)30(22(32)17-12-8-9-13-19(17)24)14-18-20(23(25,26)27)28-31(21(18)29(3)4)16-10-6-5-7-11-16/h5-13,15H,14H2,1-4H3

InChI Key

ODUUBDBOUDGSRF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19805051

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.92

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.168

Distribution Coefficient, logD

5.168

Water Solubility, LogSw

-5.37

Polar Surface Area

32.415

Acid Dissociation Constant (pKa)

23.72

Base Dissociation Constant (pKb)

-1.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with V003-3399 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-3399?
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What is the minimum amount of V003-3399 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-3399
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-3399
  • 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 V003-3399 available by request