C240-0017 Screening compound: N-(2,4-dimethoxyphenyl)-5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carboxamide

C240-0017 Screening compound: N-(2,4-dimethoxyphenyl)-5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carboxamide
C240-0017 Screening compound: N-(2,4-dimethoxyphenyl)-5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C240-0017
N-(2,4-dimethoxyphenyl)-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

C240-0017

Molecular Formula

C26H24N2O4 (C26 H24 N2 O4)

Compound Name

N-(2,4-dimethoxyphenyl)-5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carboxamide

IUPAC name

N-(24-dimethoxyphenyl)-5-oxo-7812b13-tetrahydro-5H-6-azatetraphene-13-carboxamide

SMILES

COc(cc1)cc(OC)c1NC(C(C1N2CCc3c1cccc3)c(cccc1)c1C2=O)=O

InChI

InChI=1S/C26H24N2O4/c1-31-17-11-12-21(22(15-17)32-2)27-25(29)23-19-9-5-6-10-20(19)26(30)28-14-13-16-7-3-4-8-18(16)24(23)28/h3-12,15,23-24H,13-14H2,1-2H3,(H,27,29)

InChI Key

IFQVUKHGKGHNTJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14733938

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.145

Distribution Coefficient, logD

4.139

Water Solubility, LogSw

-4.22

Polar Surface Area

53.514

Acid Dissociation Constant (pKa)

9.29

Base Dissociation Constant (pKb)

1.15

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

23.10

C240-0017 in Drug Discovery

Included in Screening Libraries

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C240-0017 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C240-0017?
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What is the minimum amount of C240-0017 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C240-0017
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C240-0017
  • 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 C240-0017 available by request