8013-5993 Screening compound: 4-(3,4-dichlorophenyl)-1H,2H,3H,4H,6H,7H,8H-cyclopenta[g]quinolin-2-one

8013-5993 Screening compound: 4-(3,4-dichlorophenyl)-1H,2H,3H,4H,6H,7H,8H-cyclopenta[g]quinolin-2-one
8013-5993 Screening compound: 4-(3,4-dichlorophenyl)-1H,2H,3H,4H,6H,7H,8H-cyclopenta[g]quinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-5993
4-(3,4-dichlorophenyl)-1H,2H,3H,4H,6H,7H,8H-cyclopenta[g]quinolin-2-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

8013-5993

Molecular Formula

C18H15Cl2NO (C18 H15 Cl2 NO)

Compound Name

4-(3,4-dichlorophenyl)-1H,2H,3H,4H,6H,7H,8H-cyclopenta[g]quinolin-2-one

IUPAC name

4-(34-dichlorophenyl)-1H2H3H4H6H7H8H-cyclopenta[g]quinolin-2-one

SMILES

O=C(CC1c(cc2)cc(Cl)c2Cl)Nc2c1cc(CCC1)c1c2

InChI

InChI=1S/C18H15Cl2NO/c19-15-5-4-12(7-16(15)20)13-9-18(22)21-17-8-11-3-1-2-10(11)6-14(13)17/h4-8,13H,1-3,9H2,(H,21,22)/t13-/m0/s1

InChI Key

QWBFZWVEOLRQMX-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD03767018

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.23

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.141

Distribution Coefficient, logD

5.141

Water Solubility, LogSw

-5.86

Polar Surface Area

25.074

Acid Dissociation Constant (pKa)

12.51

Base Dissociation Constant (pKb)

-0.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.80

8013-5993 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8013-5993 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-5993?
Check Price and Availability of 8013-5993, 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 8013-5993 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-5993
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-5993
  • 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 8013-5993 available by request