H027-0234C Screening compound: ethyl 5-hydroxy-1,2-dimethyl-6-(pyridin-3-yl)-1H-indole-3-carboxylate

H027-0234C Screening compound: ethyl 5-hydroxy-1,2-dimethyl-6-(pyridin-3-yl)-1H-indole-3-carboxylate
H027-0234C Screening compound: ethyl 5-hydroxy-1,2-dimethyl-6-(pyridin-3-yl)-1H-indole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound H027-0234C
ethyl 5-hydroxy-1,2-dimethyl-6-(pyridin-3-yl)-1H-indole-3-carboxylate

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

H027-0234C

Molecular Formula

C18H18N2O3 (C18 H18 N2 O3)

Compound Name

ethyl 5-hydroxy-1,2-dimethyl-6-(pyridin-3-yl)-1H-indole-3-carboxylate

IUPAC name

ethyl 5-hydroxy-12-dimethyl-6-(pyridin-3-yl)-1H-indole-3-carboxylate

SMILES

CCOC(c1c(C)n(C)c(cc2-c3cnccc3)c1cc2O)=O

InChI

InChI=1S/C18H18N2O3/c1-4-23-18(22)17-11(2)20(3)15-8-13(16(21)9-14(15)17)12-6-5-7-19-10-12/h5-10,21H,4H2,1-3H3

InChI Key

HUNYEDPIXHPQGP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27214776

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

310.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.853

Distribution Coefficient, logD

2.843

Water Solubility, LogSw

-2.78

Polar Surface Area

49.069

Acid Dissociation Constant (pKa)

9.09

Base Dissociation Constant (pKb)

4.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

H027-0234C in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with H027-0234C chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound H027-0234C?
Check Price and Availability of H027-0234C, 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 H027-0234C you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for H027-0234C
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for H027-0234C
  • 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 H027-0234C available by request