D634-0241 Screening compound: 6-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-3,5,9-trimethyl-7H-furo[3,2-g]chromen-7-one

D634-0241 Screening compound: 6-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-3,5,9-trimethyl-7H-furo[3,2-g]chromen-7-one
D634-0241 Screening compound: 6-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-3,5,9-trimethyl-7H-furo[3,2-g]chromen-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D634-0241
6-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-3,5,9-trimethyl-7H-furo[3,2-g]chromen-7-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

D634-0241

Molecular Formula

C29H31NO4 (C29 H31 NO4)

Compound Name

6-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-3,5,9-trimethyl-7H-furo[3,2-g]chromen-7-one

IUPAC name

6-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-359-trimethyl-7H-furo[32-g]chromen-7-one

SMILES

Cc(c1c2)coc1c(C)c(O1)c2C(C)=C(CCC(N2CCC(Cc3ccccc3)CC2)=O)C1=O

InChI

InChI=1S/C29H31NO4/c1-18-17-33-27-20(3)28-25(16-24(18)27)19(2)23(29(32)34-28)9-10-26(31)30-13-11-22(12-14-30)15-21-7-5-4-6-8-21/h4-8,16-17,22H,9-15H2,1-3H3

InChI Key

KYKXBZTVQMDTFH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13968954

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.782

Distribution Coefficient, logD

5.782

Water Solubility, LogSw

-5.75

Polar Surface Area

46.486

Acid Dissociation Constant (pKa)

23.86

Base Dissociation Constant (pKb)

-1.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.90

D634-0241 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D634-0241 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D634-0241?
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What is the minimum amount of D634-0241 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D634-0241
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D634-0241
  • 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 D634-0241 available by request