V003-7723 Screening compound: N-{[5-(4-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-(2-methylpropyl)furan-2-carboxamide

V003-7723 Screening compound: N-{[5-(4-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-(2-methylpropyl)furan-2-carboxamide
V003-7723 Screening compound: N-{[5-(4-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-(2-methylpropyl)furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-7723
N-{[5-(4-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-(2-methylpropyl)furan-2-carboxamide

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

V003-7723

Molecular Formula

C27H29N3O4 (C27 H29 N3 O4)

Compound Name

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

IUPAC name

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

SMILES

CC(C)CN(Cc(c(-c1ccccc1)nn1C)c1Oc(cc1)ccc1OC)C(c1ccco1)=O

InChI

InChI=1S/C27H29N3O4/c1-19(2)17-30(26(31)24-11-8-16-33-24)18-23-25(20-9-6-5-7-10-20)28-29(3)27(23)34-22-14-12-21(32-4)13-15-22/h5-16,19H,17-18H2,1-4H3

InChI Key

LHBCDBUQTTUNHF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19805104

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

459.55

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

4.980

Distribution Coefficient, logD

4.980

Water Solubility, LogSw

-4.66

Polar Surface Area

53.597

Acid Dissociation Constant (pKa)

23.67

Base Dissociation Constant (pKb)

-1.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

V003-7723 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V003-7723 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-7723?
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What is the minimum amount of V003-7723 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-7723
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-7723
  • 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 V003-7723 available by request