2082-0064 Screening compound: (4Z)-1-(3-chloro-4-methylphenyl)-4-[(2,5-dimethoxyphenyl)methylidene]pyrazolidine-3,5-dione

2082-0064 Screening compound: (4Z)-1-(3-chloro-4-methylphenyl)-4-[(2,5-dimethoxyphenyl)methylidene]pyrazolidine-3,5-dione
2082-0064 Screening compound: (4Z)-1-(3-chloro-4-methylphenyl)-4-[(2,5-dimethoxyphenyl)methylidene]pyrazolidine-3,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 2082-0064
(4Z)-1-(3-chloro-4-methylphenyl)-4-[(2,5-dimethoxyphenyl)methylidene]pyrazolidine-3,5-dione

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

2082-0064

Molecular Formula

C19H17ClN2O4 (C19 H17 ClN2 O4)

Compound Name

(4Z)-1-(3-chloro-4-methylphenyl)-4-[(2,5-dimethoxyphenyl)methylidene]pyrazolidine-3,5-dione

IUPAC name

(4Z)-1-(3-chloro-4-methylphenyl)-4-[(25-dimethoxyphenyl)methylidene]pyrazolidine-35-dione

SMILES

Cc(ccc(N(C(/C1=C\c(cc(cc2)OC)c2OC)=O)NC1=O)c1)c1Cl

InChI

InChI=1S/C19H17ClN2O4/c1-11-4-5-13(10-16(11)20)22-19(24)15(18(23)21-22)9-12-8-14(25-2)6-7-17(12)26-3/h4-10H,1-3H3,(H,21,23)

InChI Key

AHFIUYRTBLJCPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01158377

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.81

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.811

Distribution Coefficient, logD

3.563

Water Solubility, LogSw

-4.35

Polar Surface Area

57.934

Acid Dissociation Constant (pKa)

7.51

Base Dissociation Constant (pKb)

0.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with 2082-0064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2082-0064?
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What is the minimum amount of 2082-0064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2082-0064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2082-0064
  • 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 2082-0064 available by request