V003-8581 Screening compound: 4-[4-(furan-2-amido)phenyl]-1-(2-methylphenyl)-3-(3-methylphenyl)-1H-pyrazol-5-yl acetate

V003-8581 Screening compound: 4-[4-(furan-2-amido)phenyl]-1-(2-methylphenyl)-3-(3-methylphenyl)-1H-pyrazol-5-yl acetate
V003-8581 Screening compound: 4-[4-(furan-2-amido)phenyl]-1-(2-methylphenyl)-3-(3-methylphenyl)-1H-pyrazol-5-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-8581
4-[4-(furan-2-amido)phenyl]-1-(2-methylphenyl)-3-(3-methylphenyl)-1H-pyrazol-5-yl acetate

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

V003-8581

Molecular Formula

C30H25N3O4 (C30 H25 N3 O4)

Compound Name

4-[4-(furan-2-amido)phenyl]-1-(2-methylphenyl)-3-(3-methylphenyl)-1H-pyrazol-5-yl acetate

IUPAC name

4-[4-(furan-2-amido)phenyl]-1-(2-methylphenyl)-3-(3-methylphenyl)-1H-pyrazol-5-yl acetate

SMILES

CC(Oc(n(-c1c(C)cccc1)nc1-c2cc(C)ccc2)c1-c(cc1)ccc1NC(c1ccco1)=O)=O

InChI

InChI=1S/C30H25N3O4/c1-19-8-6-10-23(18-19)28-27(22-13-15-24(16-14-22)31-29(35)26-12-7-17-36-26)30(37-21(3)34)33(32-28)25-11-5-4-9-20(25)2/h4-18H,1-3H3,(H,31,35)

InChI Key

FDWLDBNJKZEBIA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19868815

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.206

Distribution Coefficient, logD

6.206

Water Solubility, LogSw

-5.61

Polar Surface Area

65.943

Acid Dissociation Constant (pKa)

11.85

Base Dissociation Constant (pKb)

-1.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with V003-8581 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-8581?
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What is the minimum amount of V003-8581 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-8581
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-8581
  • 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 V003-8581 available by request