V006-5455 Screening compound: N-{2-[5-(3,4-dimethoxyphenyl)-3-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclopropanecarboxamide

V006-5455 Screening compound: N-{2-[5-(3,4-dimethoxyphenyl)-3-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclopropanecarboxamide
V006-5455 Screening compound: N-{2-[5-(3,4-dimethoxyphenyl)-3-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-5455
N-{2-[5-(3,4-dimethoxyphenyl)-3-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclopropanecarboxamide

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

V006-5455

Molecular Formula

C26H30FN3O5 (C26 H30 FN3 O5)

Compound Name

N-{2-[5-(3,4-dimethoxyphenyl)-3-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclopropanecarboxamide

IUPAC name

N-{2-[5-(34-dimethoxyphenyl)-3-(2-fluorophenyl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclopropanecarboxamide

SMILES

COCCN(CC(N(C(C1)c(cc2)cc(OC)c2OC)N=C1c(cccc1)c1F)=O)C(C1CC1)=O

InChI

InChI=1S/C26H30FN3O5/c1-33-13-12-29(26(32)17-8-9-17)16-25(31)30-22(18-10-11-23(34-2)24(14-18)35-3)15-21(28-30)19-6-4-5-7-20(19)27/h4-7,10-11,14,17,22H,8-9,12-13,15-16H2,1-3H3/t22-/m1/s1

InChI Key

WDRZAQXDZZLFOU-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD19801907

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.163

Distribution Coefficient, logD

3.163

Water Solubility, LogSw

-3.38

Polar Surface Area

67.175

Acid Dissociation Constant (pKa)

18.73

Base Dissociation Constant (pKb)

2.40

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.30

V006-5455 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V006-5455 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-5455?
Check Price and Availability of V006-5455, 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 V006-5455 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-5455
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-5455
  • 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 V006-5455 available by request