V008-0509 Screening compound: 3-tert-butyl-1-cyclopropyl-1-{[3-ethyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}urea

V008-0509 Screening compound: 3-tert-butyl-1-cyclopropyl-1-{[3-ethyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}urea
V008-0509 Screening compound: 3-tert-butyl-1-cyclopropyl-1-{[3-ethyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-0509
3-tert-butyl-1-cyclopropyl-1-{[3-ethyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}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

V008-0509

Molecular Formula

C27H34N4O2 (C27 H34 N4 O2)

Compound Name

3-tert-butyl-1-cyclopropyl-1-{[3-ethyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}urea

IUPAC name

3-tert-butyl-1-cyclopropyl-1-{[3-ethyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}urea

SMILES

CCc(c(CN(C1CC1)C(NC(C)(C)C)=O)c1Oc2ccc(C)cc2)nn1-c1ccccc1

InChI

InChI=1S/C27H34N4O2/c1-6-24-23(18-30(20-14-15-20)26(32)28-27(3,4)5)25(33-22-16-12-19(2)13-17-22)31(29-24)21-10-8-7-9-11-21/h7-13,16-17,20H,6,14-15,18H2,1-5H3,(H,28,32)

InChI Key

DJGADRDVDZTFLJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19803826

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.59

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

6.454

Distribution Coefficient, logD

6.454

Water Solubility, LogSw

-5.75

Polar Surface Area

46.362

Acid Dissociation Constant (pKa)

17.34

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

References: we are preparing a list of scientific research reports with V008-0509 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-0509?
Check Price and Availability of V008-0509, 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 V008-0509 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-0509
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-0509
  • 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 V008-0509 available by request