D009-0347 Screening compound: (2Z)-3-(1-ethyl-1H-indol-3-yl)-N-[(furan-2-yl)methyl]-2-[(4-methoxyphenyl)formamido]prop-2-enamide

D009-0347 Screening compound: (2Z)-3-(1-ethyl-1H-indol-3-yl)-N-[(furan-2-yl)methyl]-2-[(4-methoxyphenyl)formamido]prop-2-enamide
D009-0347 Screening compound: (2Z)-3-(1-ethyl-1H-indol-3-yl)-N-[(furan-2-yl)methyl]-2-[(4-methoxyphenyl)formamido]prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D009-0347
(2Z)-3-(1-ethyl-1H-indol-3-yl)-N-[(furan-2-yl)methyl]-2-[(4-methoxyphenyl)formamido]prop-2-enamide

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

D009-0347

Molecular Formula

C26H25N3O4 (C26 H25 N3 O4)

Compound Name

(2Z)-3-(1-ethyl-1H-indol-3-yl)-N-[(furan-2-yl)methyl]-2-[(4-methoxyphenyl)formamido]prop-2-enamide

IUPAC name

(2Z)-3-(1-ethyl-1H-indol-3-yl)-N-[(furan-2-yl)methyl]-2-[(4-methoxyphenyl)formamido]prop-2-enamide

SMILES

CCn1c(cccc2)c2c(/C=C(/C(NCc2ccco2)=O)\NC(c(cc2)ccc2OC)=O)c1

InChI

InChI=1S/C26H25N3O4/c1-3-29-17-19(22-8-4-5-9-24(22)29)15-23(26(31)27-16-21-7-6-14-33-21)28-25(30)18-10-12-20(32-2)13-11-18/h4-15,17H,3,16H2,1-2H3,(H,27,31)(H,28,30)

InChI Key

CIWBILFTBTUWQB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14810618

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.095

Distribution Coefficient, logD

3.956

Water Solubility, LogSw

-4.03

Polar Surface Area

63.597

Acid Dissociation Constant (pKa)

7.82

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

D009-0347 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D009-0347 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D009-0347?
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What is the minimum amount of D009-0347 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D009-0347
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D009-0347
  • 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 D009-0347 available by request