C866-0011 Screening compound: 1-(2,3-dimethoxyphenyl)-2-(4-methoxyphenyl)-4-methyl-1H,2H,3H,4H-pyrrolo[3,4-b]indol-3-one

C866-0011 Screening compound: 1-(2,3-dimethoxyphenyl)-2-(4-methoxyphenyl)-4-methyl-1H,2H,3H,4H-pyrrolo[3,4-b]indol-3-one
C866-0011 Screening compound: 1-(2,3-dimethoxyphenyl)-2-(4-methoxyphenyl)-4-methyl-1H,2H,3H,4H-pyrrolo[3,4-b]indol-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C866-0011
1-(2,3-dimethoxyphenyl)-2-(4-methoxyphenyl)-4-methyl-1H,2H,3H,4H-pyrrolo[3,4-b]indol-3-one

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

C866-0011

Molecular Formula

C26H24N2O4 (C26 H24 N2 O4)

Compound Name

1-(2,3-dimethoxyphenyl)-2-(4-methoxyphenyl)-4-methyl-1H,2H,3H,4H-pyrrolo[3,4-b]indol-3-one

IUPAC name

1-(23-dimethoxyphenyl)-2-(4-methoxyphenyl)-4-methyl-1H2H3H4H-pyrrolo[34-b]indol-3-one

SMILES

Cn1c(C(N(C2c(cccc3OC)c3OC)c(cc3)ccc3OC)=O)c2c2c1cccc2

InChI

InChI=1S/C26H24N2O4/c1-27-20-10-6-5-8-18(20)22-23(19-9-7-11-21(31-3)25(19)32-4)28(26(29)24(22)27)16-12-14-17(30-2)15-13-16/h5-15,23H,1-4H3/t23-/m0/s1

InChI Key

SZMDFHIWEXJFTD-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD14802099

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.564

Distribution Coefficient, logD

4.564

Water Solubility, LogSw

-4.51

Polar Surface Area

40.220

Acid Dissociation Constant (pKa)

16.18

Base Dissociation Constant (pKb)

4.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.20

C866-0011 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C866-0011 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C866-0011?
Check Price and Availability of C866-0011, 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 C866-0011 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C866-0011
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C866-0011
  • 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 C866-0011 available by request