8010-9359 Screening compound: 3-(1H-indol-3-yl)-N~1~-(2-methoxydibenzo[b,d]furan-3-yl)propanamide

8010-9359 Screening compound: 3-(1H-indol-3-yl)-N~1~-(2-methoxydibenzo[b,d]furan-3-yl)propanamide
8010-9359 Screening compound: 3-(1H-indol-3-yl)-N~1~-(2-methoxydibenzo[b,d]furan-3-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-9359
3-(1H-indol-3-yl)-N~1~-(2-methoxydibenzo[b,d]furan-3-yl)propanamide

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

8010-9359

Molecular Formula

C24H20N2O3 (C24 H20 N2 O3)

Compound Name

3-(1H-indol-3-yl)-N~1~-(2-methoxydibenzo[b,d]furan-3-yl)propanamide

IUPAC name

3-(1H-indol-3-yl)-N-{4-methoxy-8-oxatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)351012-hexaen-5-yl}propanamide

SMILES

COc(cc(c(cccc1)c1o1)c1c1)c1NC(CCc1c[nH]c2c1cccc2)=O

InChI

InChI=1S/C24H20N2O3/c1-28-23-12-18-17-7-3-5-9-21(17)29-22(18)13-20(23)26-24(27)11-10-15-14-25-19-8-4-2-6-16(15)19/h2-9,12-14,25H,10-11H2,1H3,(H,26,27)

InChI Key

QAVBANVBDZMLBX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02615281

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.138

Distribution Coefficient, logD

5.138

Water Solubility, LogSw

-5.30

Polar Surface Area

47.834

Acid Dissociation Constant (pKa)

10.84

Base Dissociation Constant (pKb)

1.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

8010-9359 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8010-9359 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-9359?
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What is the minimum amount of 8010-9359 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-9359
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-9359
  • 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 8010-9359 available by request