C271-0309 Screening compound: N-(4-ethoxyphenyl)-2-methyl-3-(1-methyl-1H-indol-3-yl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide

C271-0309 Screening compound: N-(4-ethoxyphenyl)-2-methyl-3-(1-methyl-1H-indol-3-yl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
C271-0309 Screening compound: N-(4-ethoxyphenyl)-2-methyl-3-(1-methyl-1H-indol-3-yl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C271-0309
N-(4-ethoxyphenyl)-2-methyl-3-(1-methyl-1H-indol-3-yl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide

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

C271-0309

Molecular Formula

C28H27N3O3 (C28 H27 N3 O3)

Compound Name

N-(4-ethoxyphenyl)-2-methyl-3-(1-methyl-1H-indol-3-yl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide

IUPAC name

N-(4-ethoxyphenyl)-2-methyl-3-(1-methyl-1H-indol-3-yl)-1-oxo-1234-tetrahydroisoquinoline-4-carboxamide

SMILES

CCOc(cc1)ccc1NC(C(C(c1cn(C)c2c1cccc2)N1C)c(cccc2)c2C1=O)=O

InChI

InChI=1S/C28H27N3O3/c1-4-34-19-15-13-18(14-16-19)29-27(32)25-21-10-5-6-11-22(21)28(33)31(3)26(25)23-17-30(2)24-12-8-7-9-20(23)24/h5-17,25-26H,4H2,1-3H3,(H,29,32)

InChI Key

ANJDZPLTNAMRKC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26963722

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.136

Distribution Coefficient, logD

4.135

Water Solubility, LogSw

-3.99

Polar Surface Area

48.463

Acid Dissociation Constant (pKa)

10.74

Base Dissociation Constant (pKb)

1.40

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

21.40

C271-0309 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C271-0309 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C271-0309?
Check Price and Availability of C271-0309, 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 C271-0309 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C271-0309
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C271-0309
  • 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 C271-0309 available by request