C240-0033 Screening compound: ethyl 1-(5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carbonyl)piperidine-4-carboxylate

C240-0033 Screening compound: ethyl 1-(5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carbonyl)piperidine-4-carboxylate
C240-0033 Screening compound: ethyl 1-(5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carbonyl)piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C240-0033
ethyl 1-(5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carbonyl)piperidine-4-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

C240-0033

Molecular Formula

C26H28N2O4 (C26 H28 N2 O4)

Compound Name

ethyl 1-(5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carbonyl)piperidine-4-carboxylate

IUPAC name

ethyl 1-(5-oxo-7812b13-tetrahydro-5H-6-azatetraphene-13-carbonyl)piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(C(C1N2CCc3c1cccc3)c(cccc1)c1C2=O)=O)=O

InChI

InChI=1S/C26H28N2O4/c1-2-32-26(31)18-11-14-27(15-12-18)25(30)22-20-9-5-6-10-21(20)24(29)28-16-13-17-7-3-4-8-19(17)23(22)28/h3-10,18,22-23H,2,11-16H2,1H3

InChI Key

NEXZGWMIHFOIKH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14733950

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.328

Distribution Coefficient, logD

3.328

Water Solubility, LogSw

-3.43

Polar Surface Area

53.348

Acid Dissociation Constant (pKa)

12.66

Base Dissociation Constant (pKb)

-1.41

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

42.30

C240-0033 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Targeted Diversity Library (40567 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

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 C240-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C240-0033?
Check Price and Availability of C240-0033, 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 C240-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C240-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C240-0033
  • 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 C240-0033 available by request