3772-8067 Screening compound: 1-(4-butoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione

3772-8067 Screening compound: 1-(4-butoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione
3772-8067 Screening compound: 1-(4-butoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3772-8067
1-(4-butoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-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

3772-8067

Molecular Formula

C14H15NO3 (C14 H15 NO3)

Compound Name

1-(4-butoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione

IUPAC name

1-(4-butoxyphenyl)-25-dihydro-1H-pyrrole-25-dione

SMILES

CCCCOc(cc1)ccc1N(C(C=C1)=O)C1=O

InChI

InChI=1S/C14H15NO3/c1-2-3-10-18-12-6-4-11(5-7-12)15-13(16)8-9-14(15)17/h4-9H,2-3,10H2,1H3

InChI Key

QPSIVQYERUUXJE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00450955

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

245.28

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.646

Distribution Coefficient, logD

2.646

Water Solubility, LogSw

-2.76

Polar Surface Area

37.125

Acid Dissociation Constant (pKa)

27.52

Base Dissociation Constant (pKb)

3.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

3772-8067 in Drug Discovery

Included in Screening Libraries

Nucleoside Mimetics Library (2197 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Cancer
  • Immune system
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with 3772-8067 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3772-8067?
Check Price and Availability of 3772-8067, 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 3772-8067 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3772-8067
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3772-8067
  • 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 3772-8067 available by request