C095-0297 Screening compound: 4-bromo-N~1~-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]-3-methoxybenzamide

C095-0297 Screening compound: 4-bromo-N~1~-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]-3-methoxybenzamide
C095-0297 Screening compound: 4-bromo-N~1~-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]-3-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C095-0297
4-bromo-N~1~-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]-3-methoxybenzamide

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

C095-0297

Molecular Formula

C24H27BrN4O2 (C24 H27 BrN4 O2)

Compound Name

4-bromo-N~1~-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]-3-methoxybenzamide

IUPAC name

4-bromo-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]-3-methoxybenzamide

SMILES

CCN(CC1)CCN1c1cc(C)c(cc(cc2)NC(c(cc3)cc(OC)c3Br)=O)c2n1

InChI

InChI=1S/C24H27BrN4O2/c1-4-28-9-11-29(12-10-28)23-13-16(2)19-15-18(6-8-21(19)27-23)26-24(30)17-5-7-20(25)22(14-17)31-3/h5-8,13-15H,4,9-12H2,1-3H3,(H,26,30)

InChI Key

IWLHZNVXXRDRFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14719112

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.341

Distribution Coefficient, logD

4.654

Water Solubility, LogSw

-5.43

Polar Surface Area

45.743

Acid Dissociation Constant (pKa)

9.52

Base Dissociation Constant (pKb)

7.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

C095-0297 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C095-0297 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C095-0297?
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What is the minimum amount of C095-0297 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C095-0297
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C095-0297
  • 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 C095-0297 available by request