V002-2587 Screening compound: 3-(3,4-dimethoxyphenyl)-1-(3-methylphenyl)-4-[4-(thiophene-2-amido)phenyl]-1H-pyrazol-5-yl acetate

V002-2587 Screening compound: 3-(3,4-dimethoxyphenyl)-1-(3-methylphenyl)-4-[4-(thiophene-2-amido)phenyl]-1H-pyrazol-5-yl acetate
V002-2587 Screening compound: 3-(3,4-dimethoxyphenyl)-1-(3-methylphenyl)-4-[4-(thiophene-2-amido)phenyl]-1H-pyrazol-5-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-2587
3-(3,4-dimethoxyphenyl)-1-(3-methylphenyl)-4-[4-(thiophene-2-amido)phenyl]-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

V002-2587

Molecular Formula

C31H27N3O5S (C31 H27 N3 O5 S)

Compound Name

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

IUPAC name

3-(34-dimethoxyphenyl)-1-(3-methylphenyl)-4-[4-(thiophene-2-amido)phenyl]-1H-pyrazol-5-yl acetate

SMILES

CC(Oc(n(-c1cc(C)ccc1)nc1-c(cc2)cc(OC)c2OC)c1-c(cc1)ccc1NC(c1cccs1)=O)=O

InChI

InChI=1S/C31H27N3O5S/c1-19-7-5-8-24(17-19)34-31(39-20(2)35)28(29(33-34)22-12-15-25(37-3)26(18-22)38-4)21-10-13-23(14-11-21)32-30(36)27-9-6-16-40-27/h5-18H,1-4H3,(H,32,36)

InChI Key

SUNRESCZWVMUPP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19868536

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

553.64

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.208

Distribution Coefficient, logD

6.208

Water Solubility, LogSw

-5.61

Polar Surface Area

73.944

Acid Dissociation Constant (pKa)

12.30

Base Dissociation Constant (pKb)

-0.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.90

References: we are preparing a list of scientific research reports with V002-2587 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-2587?
Check Price and Availability of V002-2587, 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 V002-2587 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-2587
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-2587
  • 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 V002-2587 available by request