3202-0280 Screening compound: (4E)-4-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-ethoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione

3202-0280 Screening compound: (4E)-4-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-ethoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
3202-0280 Screening compound: (4E)-4-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-ethoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3202-0280
(4E)-4-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-ethoxyphenyl)methylidene]-1-phenylpyrazolidine-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

3202-0280

Molecular Formula

C30H32N2O5 (C30 H32 N2 O5)

Compound Name

(4E)-4-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-ethoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione

IUPAC name

(4E)-4-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-ethoxyphenyl)methylidene]-1-phenylpyrazolidine-35-dione

SMILES

CCC(C)c(cc1)ccc1OCCOc(ccc(/C=C(\C(NN1c2ccccc2)=O)/C1=O)c1)c1OCC

InChI

InChI=1S/C30H32N2O5/c1-4-21(3)23-12-14-25(15-13-23)36-17-18-37-27-16-11-22(20-28(27)35-5-2)19-26-29(33)31-32(30(26)34)24-9-7-6-8-10-24/h6-16,19-21H,4-5,17-18H2,1-3H3,(H,31,33)/t21-/m0/s1

InChI Key

YPRCBIUFSUOCLR-NRFANRHFSA-N

MDL Number (MFCD)

MFCD02017632

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

500.59

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.539

Distribution Coefficient, logD

5.476

Water Solubility, LogSw

-5.46

Polar Surface Area

64.621

Acid Dissociation Constant (pKa)

8.21

Base Dissociation Constant (pKb)

-7.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.70

3202-0280 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with 3202-0280 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3202-0280?
Check Price and Availability of 3202-0280, 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 3202-0280 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3202-0280
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3202-0280
  • 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 3202-0280 available by request