V004-1168 Screening compound: N~2~-(cyclopropylmethyl)-N~2~-{[5-(3-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-2-furamide

V004-1168 Screening compound: N~2~-(cyclopropylmethyl)-N~2~-{[5-(3-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-2-furamide
V004-1168 Screening compound: N~2~-(cyclopropylmethyl)-N~2~-{[5-(3-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-2-furamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-1168
N~2~-(cyclopropylmethyl)-N~2~-{[5-(3-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-2-furamide

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

V004-1168

Molecular Formula

C27H27N3O4 (C27 H27 N3 O4)

Compound Name

N~2~-(cyclopropylmethyl)-N~2~-{[5-(3-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-2-furamide

IUPAC name

N-(cyclopropylmethyl)-N-{[5-(3-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}furan-2-carboxamide

SMILES

Cc(c(CN(CC1CC1)C(c1ccco1)=O)c1Oc2cc(OC)ccc2)nn1-c1ccccc1

InChI

InChI=1S/C27H27N3O4/c1-19-24(18-29(17-20-13-14-20)26(31)25-12-7-15-33-25)27(30(28-19)21-8-4-3-5-9-21)34-23-11-6-10-22(16-23)32-2/h3-12,15-16,20H,13-14,17-18H2,1-2H3

InChI Key

RBFOBBXGNNAZFP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19805575

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.974

Distribution Coefficient, logD

4.974

Water Solubility, LogSw

-4.88

Polar Surface Area

53.505

Acid Dissociation Constant (pKa)

24.79

Base Dissociation Constant (pKb)

-0.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.93

References: we are preparing a list of scientific research reports with V004-1168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-1168?
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What is the minimum amount of V004-1168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-1168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-1168
  • 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 V004-1168 available by request