C240-0173 Screening compound: 13-(4-cyclohexylpiperazine-1-carbonyl)-7,8,12b,13-tetrahydro-5H-6-azatetraphen-5-one

C240-0173 Screening compound: 13-(4-cyclohexylpiperazine-1-carbonyl)-7,8,12b,13-tetrahydro-5H-6-azatetraphen-5-one
C240-0173 Screening compound: 13-(4-cyclohexylpiperazine-1-carbonyl)-7,8,12b,13-tetrahydro-5H-6-azatetraphen-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C240-0173
13-(4-cyclohexylpiperazine-1-carbonyl)-7,8,12b,13-tetrahydro-5H-6-azatetraphen-5-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

C240-0173

Molecular Formula

C28H33N3O2 (C28 H33 N3 O2)

Compound Name

13-(4-cyclohexylpiperazine-1-carbonyl)-7,8,12b,13-tetrahydro-5H-6-azatetraphen-5-one

IUPAC name

13-(4-cyclohexylpiperazine-1-carbonyl)-7812b13-tetrahydro-5H-6-azatetraphen-5-one

SMILES

O=C(C(C1N2CCc3c1cccc3)c(cccc1)c1C2=O)N(CC1)CCN1C1CCCCC1

InChI

InChI=1S/C28H33N3O2/c32-27-24-13-7-6-12-23(24)25(26-22-11-5-4-8-20(22)14-15-31(26)27)28(33)30-18-16-29(17-19-30)21-9-2-1-3-10-21/h4-8,11-13,21,25-26H,1-3,9-10,14-19H2

InChI Key

SLIZCCINQZPUTQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05027263

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.59

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.072

Distribution Coefficient, logD

3.690

Water Solubility, LogSw

-4.18

Polar Surface Area

35.688

Acid Dissociation Constant (pKa)

12.66

Base Dissociation Constant (pKb)

7.55

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

50.00

C240-0173 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

GPCR Targeted Library (31838 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators

References: we are preparing a list of scientific research reports with C240-0173 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C240-0173?
Check Price and Availability of C240-0173, 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 C240-0173 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C240-0173
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C240-0173
  • 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 C240-0173 available by request