C095-0269 Screening compound: 4-butyl-N-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]benzamide

C095-0269 Screening compound: 4-butyl-N-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]benzamide
C095-0269 Screening compound: 4-butyl-N-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C095-0269
4-butyl-N-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]benzamide

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

C095-0269

Molecular Formula

C27H34N4O (C27 H34 N4 O)

Compound Name

4-butyl-N-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]benzamide

IUPAC name

4-butyl-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]benzamide

SMILES

CCCCc(cc1)ccc1C(Nc1cc2c(C)cc(N3CCN(CC)CC3)nc2cc1)=O

InChI

InChI=1S/C27H34N4O/c1-4-6-7-21-8-10-22(11-9-21)27(32)28-23-12-13-25-24(19-23)20(3)18-26(29-25)31-16-14-30(5-2)15-17-31/h8-13,18-19H,4-7,14-17H2,1-3H3,(H,28,32)

InChI Key

VERXMSNVBNWROJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14719099

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.59

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.621

Distribution Coefficient, logD

5.934

Water Solubility, LogSw

-5.64

Polar Surface Area

38.113

Acid Dissociation Constant (pKa)

9.76

Base Dissociation Constant (pKb)

7.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.74

C095-0269 in Drug Discovery

Included in Screening Libraries

Human GPCR Annotated Library (5539 compounds)

Human Kinases Annotated Library (2415 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epigenetics Focused Set (26518 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with C095-0269 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C095-0269?
Check Price and Availability of C095-0269, 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 C095-0269 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C095-0269
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C095-0269
  • 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 C095-0269 available by request