D159-0041 Screening compound: 6,8-dimethyl-1-(4-methylphenyl)-2-propyl-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione

D159-0041 Screening compound: 6,8-dimethyl-1-(4-methylphenyl)-2-propyl-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione
D159-0041 Screening compound: 6,8-dimethyl-1-(4-methylphenyl)-2-propyl-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D159-0041
6,8-dimethyl-1-(4-methylphenyl)-2-propyl-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-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

D159-0041

Molecular Formula

C23H23NO3 (C23 H23 NO3)

Compound Name

6,8-dimethyl-1-(4-methylphenyl)-2-propyl-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione

IUPAC name

68-dimethyl-1-(4-methylphenyl)-2-propyl-1H2H3H9H-chromeno[23-c]pyrrole-39-dione

SMILES

CCCN(C(C1=C2Oc(cc(C)cc3C)c3C1=O)c1ccc(C)cc1)C2=O

InChI

InChI=1S/C23H23NO3/c1-5-10-24-20(16-8-6-13(2)7-9-16)19-21(25)18-15(4)11-14(3)12-17(18)27-22(19)23(24)26/h6-9,11-12,20H,5,10H2,1-4H3/t20-/m1/s1

InChI Key

PMZRULWTWQIVSU-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD06648088

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.217

Distribution Coefficient, logD

5.217

Water Solubility, LogSw

-5.08

Polar Surface Area

36.983

Acid Dissociation Constant (pKa)

18.11

Base Dissociation Constant (pKb)

-4.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.40

D159-0041 in Drug Discovery

Included in Screening Libraries

Cysteine Proteases Inhibitors Library (7839 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Cardiovascular
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with D159-0041 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D159-0041?
Check Price and Availability of D159-0041, 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 D159-0041 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D159-0041
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D159-0041
  • 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 D159-0041 available by request