V010-0796 Screening compound: 1-(2-fluorophenyl)-3-[3-(3-methoxyphenyl)-5-methyl-1H-pyrazol-4-yl]urea

V010-0796 Screening compound: 1-(2-fluorophenyl)-3-[3-(3-methoxyphenyl)-5-methyl-1H-pyrazol-4-yl]urea
V010-0796 Screening compound: 1-(2-fluorophenyl)-3-[3-(3-methoxyphenyl)-5-methyl-1H-pyrazol-4-yl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-0796
1-(2-fluorophenyl)-3-[3-(3-methoxyphenyl)-5-methyl-1H-pyrazol-4-yl]urea

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

V010-0796

Molecular Formula

C18H17FN4O2 (C18 H17 FN4 O2)

Compound Name

1-(2-fluorophenyl)-3-[3-(3-methoxyphenyl)-5-methyl-1H-pyrazol-4-yl]urea

IUPAC name

1-(2-fluorophenyl)-3-[3-(3-methoxyphenyl)-5-methyl-1H-pyrazol-4-yl]urea

SMILES

Cc([nH]nc1-c2cc(OC)ccc2)c1NC(Nc(cccc1)c1F)=O

InChI

InChI=1S/C18H17FN4O2/c1-11-16(21-18(24)20-15-9-4-3-8-14(15)19)17(23-22-11)12-6-5-7-13(10-12)25-2/h3-10H,1-2H3,(H,22,23)(H2,20,21,24)

InChI Key

IBKPVKOGVIAREB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14267839

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

340.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.510

Distribution Coefficient, logD

3.510

Water Solubility, LogSw

-3.87

Polar Surface Area

61.829

Acid Dissociation Constant (pKa)

11.38

Base Dissociation Constant (pKb)

-0.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

V010-0796 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V010-0796 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-0796?
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What is the minimum amount of V010-0796 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-0796
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-0796
  • 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 V010-0796 available by request