C095-0301 Screening compound: N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]-2,3-dimethoxybenzamide

C095-0301 Screening compound: N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]-2,3-dimethoxybenzamide
C095-0301 Screening compound: N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]-2,3-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C095-0301
N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]-2,3-dimethoxybenzamide

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

C095-0301

Molecular Formula

C25H30N4O3 (C25 H30 N4 O3)

Compound Name

N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]-2,3-dimethoxybenzamide

IUPAC name

N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]-23-dimethoxybenzamide

SMILES

CCN(CC1)CCN1c1cc(C)c(cc(cc2)NC(c(cccc3OC)c3OC)=O)c2n1

InChI

InChI=1S/C25H30N4O3/c1-5-28-11-13-29(14-12-28)23-15-17(2)20-16-18(9-10-21(20)27-23)26-25(30)19-7-6-8-22(31-3)24(19)32-4/h6-10,15-16H,5,11-14H2,1-4H3,(H,26,30)

InChI Key

DTSBOMULJWKIAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14719115

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.462

Distribution Coefficient, logD

3.774

Water Solubility, LogSw

-4.27

Polar Surface Area

53.461

Acid Dissociation Constant (pKa)

9.18

Base Dissociation Constant (pKb)

7.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

C095-0301 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with C095-0301 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C095-0301?
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What is the minimum amount of C095-0301 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C095-0301
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C095-0301
  • 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 C095-0301 available by request