C267-0306 Screening compound: ethyl 4-{[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]carbamothioyl}piperazine-1-carboxylate

C267-0306 Screening compound: ethyl 4-{[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]carbamothioyl}piperazine-1-carboxylate
C267-0306 Screening compound: ethyl 4-{[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]carbamothioyl}piperazine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C267-0306
ethyl 4-{[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]carbamothioyl}piperazine-1-carboxylate

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

C267-0306

Molecular Formula

C23H32N6O2S (C23 H32 N6 O2 S)

Compound Name

ethyl 4-{[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]carbamothioyl}piperazine-1-carboxylate

IUPAC name

ethyl 4-{[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]carbamothioyl}piperazine-1-carboxylate

SMILES

CCOC(N(CC1)CCN1C(Nc1cc2c(C)cc(N3CCN(C)CC3)nc2cc1)=S)=O

InChI

InChI=1S/C23H32N6O2S/c1-4-31-23(30)29-13-11-28(12-14-29)22(32)24-18-5-6-20-19(16-18)17(2)15-21(25-20)27-9-7-26(3)8-10-27/h5-6,15-16H,4,7-14H2,1-3H3,(H,24,32)

InChI Key

DSTKHHJELJNDIH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05032175

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.61

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.050

Distribution Coefficient, logD

3.480

Water Solubility, LogSw

-3.94

Polar Surface Area

48.640

Acid Dissociation Constant (pKa)

13.71

Base Dissociation Constant (pKb)

7.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.20

C267-0306 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C267-0306 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C267-0306?
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What is the minimum amount of C267-0306 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C267-0306
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C267-0306
  • 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 C267-0306 available by request