D658-0385 Screening compound: 1-(4-butoxy-3-methoxyphenyl)-2-[3-(dimethylamino)propyl]-6,7-dimethyl-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione

D658-0385 Screening compound: 1-(4-butoxy-3-methoxyphenyl)-2-[3-(dimethylamino)propyl]-6,7-dimethyl-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione
D658-0385 Screening compound: 1-(4-butoxy-3-methoxyphenyl)-2-[3-(dimethylamino)propyl]-6,7-dimethyl-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D658-0385
1-(4-butoxy-3-methoxyphenyl)-2-[3-(dimethylamino)propyl]-6,7-dimethyl-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

D658-0385

Molecular Formula

C29H36N2O5 (C29 H36 N2 O5)

Compound Name

1-(4-butoxy-3-methoxyphenyl)-2-[3-(dimethylamino)propyl]-6,7-dimethyl-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione

IUPAC name

1-(4-butoxy-3-methoxyphenyl)-2-[3-(dimethylamino)propyl]-67-dimethyl-1H2H3H9H-chromeno[23-c]pyrrole-39-dione

SMILES

CCCCOc(ccc(C(C1=C2Oc(cc(C)c(C)c3)c3C1=O)N(CCCN(C)C)C2=O)c1)c1OC

InChI

InChI=1S/C29H36N2O5/c1-7-8-14-35-22-11-10-20(17-24(22)34-6)26-25-27(32)21-15-18(2)19(3)16-23(21)36-28(25)29(33)31(26)13-9-12-30(4)5/h10-11,15-17,26H,7-9,12-14H2,1-6H3/t26-/m1/s1

InChI Key

CPLDQJHNIBRWLU-AREMUKBSSA-N

MDL Number (MFCD)

MFCD04448575

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.62

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.084

Distribution Coefficient, logD

3.135

Water Solubility, LogSw

-4.85

Polar Surface Area

55.983

Acid Dissociation Constant (pKa)

18.11

Base Dissociation Constant (pKb)

9.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.80

D658-0385 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Cysteine Proteases Inhibitors Library (7839 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • 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 D658-0385 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D658-0385?
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What is the minimum amount of D658-0385 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D658-0385
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D658-0385
  • 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 D658-0385 available by request