C240-0043 Screening compound: N-[(2-methoxyphenyl)methyl]-5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carboxamide

C240-0043 Screening compound: N-[(2-methoxyphenyl)methyl]-5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carboxamide
C240-0043 Screening compound: N-[(2-methoxyphenyl)methyl]-5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C240-0043
N-[(2-methoxyphenyl)methyl]-5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-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

C240-0043

Molecular Formula

C26H24N2O3 (C26 H24 N2 O3)

Compound Name

N-[(2-methoxyphenyl)methyl]-5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carboxamide

IUPAC name

N-[(2-methoxyphenyl)methyl]-5-oxo-7812b13-tetrahydro-5H-6-azatetraphene-13-carboxamide

SMILES

COc1c(CNC(C(C2N3CCc4c2cccc4)c(cccc2)c2C3=O)=O)cccc1

InChI

InChI=1S/C26H24N2O3/c1-31-22-13-7-3-9-18(22)16-27-25(29)23-20-11-5-6-12-21(20)26(30)28-15-14-17-8-2-4-10-19(17)24(23)28/h2-13,23-24H,14-16H2,1H3,(H,27,29)

InChI Key

UUQHNCITTXLTCW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14733952

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.750

Distribution Coefficient, logD

3.750

Water Solubility, LogSw

-3.94

Polar Surface Area

47.990

Acid Dissociation Constant (pKa)

11.55

Base Dissociation Constant (pKb)

-3.33

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

23.10

C240-0043 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antifungal Library (16415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
Agro:
  • Agro
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C240-0043 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C240-0043?
Check Price and Availability of C240-0043, 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 C240-0043 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C240-0043
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C240-0043
  • 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 C240-0043 available by request