V029-6995 Screening compound: 1-(butan-2-yl)-1-{[5-(2-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-3-(propan-2-yl)urea

V029-6995 Screening compound: 1-(butan-2-yl)-1-{[5-(2-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-3-(propan-2-yl)urea
V029-6995 Screening compound: 1-(butan-2-yl)-1-{[5-(2-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-3-(propan-2-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-6995
1-(butan-2-yl)-1-{[5-(2-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-3-(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

V029-6995

Molecular Formula

C26H34N4O3 (C26 H34 N4 O3)

Compound Name

1-(butan-2-yl)-1-{[5-(2-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-3-(propan-2-yl)urea

IUPAC name

1-(butan-2-yl)-1-{[5-(2-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-3-(propan-2-yl)urea

SMILES

CCC(C)N(Cc(c(-c1ccccc1)nn1C)c1Oc(cccc1)c1OC)C(NC(C)C)=O

InChI

InChI=1S/C26H34N4O3/c1-7-19(4)30(26(31)27-18(2)3)17-21-24(20-13-9-8-10-14-20)28-29(5)25(21)33-23-16-12-11-15-22(23)32-6/h8-16,18-19H,7,17H2,1-6H3,(H,27,31)/t19-/m0/s1

InChI Key

GDGYCQRRFQSNCU-IBGZPJMESA-N

MDL Number (MFCD)

MFCD19805137

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

450.58

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.186

Distribution Coefficient, logD

5.186

Water Solubility, LogSw

-5.13

Polar Surface Area

53.909

Acid Dissociation Constant (pKa)

17.61

Base Dissociation Constant (pKb)

1.25

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with V029-6995 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-6995?
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What is the minimum amount of V029-6995 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-6995
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-6995
  • 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 V029-6995 available by request