V030-7531 Screening compound: N-{2-[3-(2-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-methyl-4-(trifluoromethyl)benzamide

V030-7531 Screening compound: N-{2-[3-(2-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-methyl-4-(trifluoromethyl)benzamide
V030-7531 Screening compound: N-{2-[3-(2-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-methyl-4-(trifluoromethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-7531
N-{2-[3-(2-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-methyl-4-(trifluoromethyl)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

V030-7531

Molecular Formula

C27H23F4N3O2 (C27 H23 F4 N3 O2)

Compound Name

N-{2-[3-(2-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-methyl-4-(trifluoromethyl)benzamide

IUPAC name

N-{2-[3-(2-fluorophenyl)-5-(4-methylphenyl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-methyl-4-(trifluoromethyl)benzamide

SMILES

Cc1ccc(C(C2)N(C(CN(C)C(c3ccc(C(F)(F)F)cc3)=O)=O)N=C2c(cccc2)c2F)cc1

InChI

InChI=1S/C27H23F4N3O2/c1-17-7-9-18(10-8-17)24-15-23(21-5-3-4-6-22(21)28)32-34(24)25(35)16-33(2)26(36)19-11-13-20(14-12-19)27(29,30)31/h3-14,24H,15-16H2,1-2H3/t24-/m1/s1

InChI Key

ZZHYQUALNURQOS-XMMPIXPASA-N

MDL Number (MFCD)

MFCD20500020

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

497.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.312

Distribution Coefficient, logD

5.312

Water Solubility, LogSw

-5.30

Polar Surface Area

43.009

Acid Dissociation Constant (pKa)

18.73

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with V030-7531 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-7531?
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What is the minimum amount of V030-7531 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-7531
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-7531
  • 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 V030-7531 available by request