D086-0366 Screening compound: 5-amino-4-(1H-1,3-benzodiazol-2-yl)-1-(4-hydroxyphenyl)-2,3-dihydro-1H-pyrrol-3-one

D086-0366 Screening compound: 5-amino-4-(1H-1,3-benzodiazol-2-yl)-1-(4-hydroxyphenyl)-2,3-dihydro-1H-pyrrol-3-one
D086-0366 Screening compound: 5-amino-4-(1H-1,3-benzodiazol-2-yl)-1-(4-hydroxyphenyl)-2,3-dihydro-1H-pyrrol-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D086-0366
5-amino-4-(1H-1,3-benzodiazol-2-yl)-1-(4-hydroxyphenyl)-2,3-dihydro-1H-pyrrol-3-one

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

D086-0366

Molecular Formula

C17H14N4O2 (C17 H14 N4 O2)

Compound Name

5-amino-4-(1H-1,3-benzodiazol-2-yl)-1-(4-hydroxyphenyl)-2,3-dihydro-1H-pyrrol-3-one

IUPAC name

5-amino-4-(1H-13-benzodiazol-2-yl)-1-(4-hydroxyphenyl)-23-dihydro-1H-pyrrol-3-one

SMILES

NC(N(CC1=O)c(cc2)ccc2O)=C1c1nc(cccc2)c2[nH]1

InChI

InChI=1S/C17H14N4O2/c18-16-15(17-19-12-3-1-2-4-13(12)20-17)14(23)9-21(16)10-5-7-11(22)8-6-10/h1-8,22H,9,18H2,(H,19,20)

InChI Key

BLGWFYMLZHYXLN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07189661

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.806

Distribution Coefficient, logD

1.806

Water Solubility, LogSw

-2.17

Polar Surface Area

73.607

Acid Dissociation Constant (pKa)

10.53

Base Dissociation Constant (pKb)

-0.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

D086-0366 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Human Kinases Annotated Library (2415 compounds)

Antibacterial Compounds Library (13827 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D086-0366 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D086-0366?
Check Price and Availability of D086-0366, 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 D086-0366 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D086-0366
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D086-0366
  • 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 D086-0366 available by request