C095-0310 Screening compound: N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]pyridine-2-carboxamide

C095-0310 Screening compound: N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]pyridine-2-carboxamide
C095-0310 Screening compound: N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]pyridine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C095-0310
N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]pyridine-2-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

C095-0310

Molecular Formula

C22H25N5O (C22 H25 N5 O)

Compound Name

N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]pyridine-2-carboxamide

IUPAC name

N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]pyridine-2-carboxamide

SMILES

CCN(CC1)CCN1c1cc(C)c(cc(cc2)NC(c3ncccc3)=O)c2n1

InChI

InChI=1S/C22H25N5O/c1-3-26-10-12-27(13-11-26)21-14-16(2)18-15-17(7-8-19(18)25-21)24-22(28)20-6-4-5-9-23-20/h4-9,14-15H,3,10-13H2,1-2H3,(H,24,28)

InChI Key

FQGYAONMXPMKFV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15074419

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.781

Distribution Coefficient, logD

3.093

Water Solubility, LogSw

-3.82

Polar Surface Area

47.161

Acid Dissociation Constant (pKa)

9.71

Base Dissociation Constant (pKb)

7.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.82

C095-0310 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Lipid Metabolism Library (9174 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with C095-0310 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C095-0310?
Check Price and Availability of C095-0310, 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 C095-0310 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C095-0310
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C095-0310
  • 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 C095-0310 available by request