V008-1308 Screening compound: 1-{[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-1H-pyrazol-4-yl]methyl}-1,3-bis(propan-2-yl)urea

V008-1308 Screening compound: 1-{[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-1H-pyrazol-4-yl]methyl}-1,3-bis(propan-2-yl)urea
V008-1308 Screening compound: 1-{[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-1H-pyrazol-4-yl]methyl}-1,3-bis(propan-2-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-1308
1-{[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-1H-pyrazol-4-yl]methyl}-1,3-bis(propan-2-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

V008-1308

Molecular Formula

C25H31FN4O2 (C25 H31 FN4 O2)

Compound Name

1-{[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-1H-pyrazol-4-yl]methyl}-1,3-bis(propan-2-yl)urea

IUPAC name

1-{[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-1H-pyrazol-4-yl]methyl}-13-bis(propan-2-yl)urea

SMILES

CCc(c(CN(C(C)C)C(NC(C)C)=O)c1Oc2ccccc2)nn1-c(cc1)ccc1F

InChI

InChI=1S/C25H31FN4O2/c1-6-23-22(16-29(18(4)5)25(31)27-17(2)3)24(32-21-10-8-7-9-11-21)30(28-23)20-14-12-19(26)13-15-20/h7-15,17-18H,6,16H2,1-5H3,(H,27,31)

InChI Key

VORHQGOZXMVNSS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19802667

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.55

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.876

Distribution Coefficient, logD

5.876

Water Solubility, LogSw

-5.53

Polar Surface Area

46.952

Acid Dissociation Constant (pKa)

17.61

Base Dissociation Constant (pKb)

1.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

References: we are preparing a list of scientific research reports with V008-1308 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-1308?
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What is the minimum amount of V008-1308 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-1308
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-1308
  • 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 V008-1308 available by request