C237-2227 Screening compound: N-{3-[butyl(ethyl)amino]propyl}-9-methyl-2-(2-methylpropyl)-1-oxo-1H,2H,9H-pyrido[3,4-b]indole-4-carboxamide

C237-2227 Screening compound: N-{3-[butyl(ethyl)amino]propyl}-9-methyl-2-(2-methylpropyl)-1-oxo-1H,2H,9H-pyrido[3,4-b]indole-4-carboxamide
C237-2227 Screening compound: N-{3-[butyl(ethyl)amino]propyl}-9-methyl-2-(2-methylpropyl)-1-oxo-1H,2H,9H-pyrido[3,4-b]indole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C237-2227
N-{3-[butyl(ethyl)amino]propyl}-9-methyl-2-(2-methylpropyl)-1-oxo-1H,2H,9H-pyrido[3,4-b]indole-4-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

C237-2227

Molecular Formula

C26H38N4O2 (C26 H38 N4 O2)

Compound Name

N-{3-[butyl(ethyl)amino]propyl}-9-methyl-2-(2-methylpropyl)-1-oxo-1H,2H,9H-pyrido[3,4-b]indole-4-carboxamide

IUPAC name

N-{3-[butyl(ethyl)amino]propyl}-9-methyl-2-(2-methylpropyl)-1-oxo-1H2H9H-pyrido[34-b]indole-4-carboxamide

SMILES

CCCCN(CC)CCCNC(C(c1c2n(C)c3c1cccc3)=CN(CC(C)C)C2=O)=O

InChI

InChI=1S/C26H38N4O2/c1-6-8-15-29(7-2)16-11-14-27-25(31)21-18-30(17-19(3)4)26(32)24-23(21)20-12-9-10-13-22(20)28(24)5/h9-10,12-13,18-19H,6-8,11,14-17H2,1-5H3,(H,27,31)

InChI Key

YZUIWYODBFVNFX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03829569

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.61

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.533

Distribution Coefficient, logD

0.840

Water Solubility, LogSw

-3.83

Polar Surface Area

46.586

Acid Dissociation Constant (pKa)

13.63

Base Dissociation Constant (pKb)

10.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.80

C237-2227 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Mimetics
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C237-2227 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C237-2227?
Check Price and Availability of C237-2227, 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 C237-2227 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C237-2227
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C237-2227
  • 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 C237-2227 available by request