C267-0191 Screening compound: ethyl 4-({[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]carbamothioyl}amino)piperidine-1-carboxylate

C267-0191 Screening compound: ethyl 4-({[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]carbamothioyl}amino)piperidine-1-carboxylate
C267-0191 Screening compound: ethyl 4-({[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]carbamothioyl}amino)piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C267-0191
ethyl 4-({[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]carbamothioyl}amino)piperidine-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

C267-0191

Molecular Formula

C25H36N6O2S (C25 H36 N6 O2 S)

Compound Name

ethyl 4-({[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]carbamothioyl}amino)piperidine-1-carboxylate

IUPAC name

ethyl 4-({[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]carbamothioyl}amino)piperidine-1-carboxylate

SMILES

CCN(CC1)CCN1c1cc(C)c(cc(cc2)NC(NC(CC3)CCN3C(OCC)=O)=S)c2n1

InChI

InChI=1S/C25H36N6O2S/c1-4-29-12-14-30(15-13-29)23-16-18(3)21-17-20(6-7-22(21)28-23)27-24(34)26-19-8-10-31(11-9-19)25(32)33-5-2/h6-7,16-17,19H,4-5,8-15H2,1-3H3,(H2,26,27,34)

InChI Key

BUPKLPQDHAPGPJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14739515

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.67

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.472

Distribution Coefficient, logD

3.785

Water Solubility, LogSw

-4.16

Polar Surface Area

57.672

Acid Dissociation Constant (pKa)

13.95

Base Dissociation Constant (pKb)

7.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.00

C267-0191 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 C267-0191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C267-0191?
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What is the minimum amount of C267-0191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C267-0191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C267-0191
  • 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 C267-0191 available by request