D009-0459 Screening compound: (2Z)-N-(3-hydroxypropyl)-3-(1-methyl-1H-indol-3-yl)-2-[(3,4,5-trimethoxyphenyl)formamido]prop-2-enamide

D009-0459 Screening compound: (2Z)-N-(3-hydroxypropyl)-3-(1-methyl-1H-indol-3-yl)-2-[(3,4,5-trimethoxyphenyl)formamido]prop-2-enamide
D009-0459 Screening compound: (2Z)-N-(3-hydroxypropyl)-3-(1-methyl-1H-indol-3-yl)-2-[(3,4,5-trimethoxyphenyl)formamido]prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D009-0459
(2Z)-N-(3-hydroxypropyl)-3-(1-methyl-1H-indol-3-yl)-2-[(3,4,5-trimethoxyphenyl)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

D009-0459

Molecular Formula

C25H29N3O6 (C25 H29 N3 O6)

Compound Name

(2Z)-N-(3-hydroxypropyl)-3-(1-methyl-1H-indol-3-yl)-2-[(3,4,5-trimethoxyphenyl)formamido]prop-2-enamide

IUPAC name

(2Z)-N-(3-hydroxypropyl)-3-(1-methyl-1H-indol-3-yl)-2-[(345-trimethoxyphenyl)formamido]prop-2-enamide

SMILES

Cn1c(cccc2)c2c(/C=C(/C(NCCCO)=O)\NC(c(cc2OC)cc(OC)c2OC)=O)c1

InChI

InChI=1S/C25H29N3O6/c1-28-15-17(18-8-5-6-9-20(18)28)12-19(25(31)26-10-7-11-29)27-24(30)16-13-21(32-2)23(34-4)22(14-16)33-3/h5-6,8-9,12-15,29H,7,10-11H2,1-4H3,(H,26,31)(H,27,30)

InChI Key

DCRSPUGRMBUXKP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10474001

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.639

Distribution Coefficient, logD

1.619

Water Solubility, LogSw

-2.40

Polar Surface Area

88.882

Acid Dissociation Constant (pKa)

8.73

Base Dissociation Constant (pKb)

4.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

D009-0459 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with D009-0459 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D009-0459?
Check Price and Availability of D009-0459, 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 D009-0459 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D009-0459
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D009-0459
  • 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 D009-0459 available by request