E692-1567 Screening compound: 1-(5-chloro-2-methylphenyl)-4-{1-[(4-methylpiperidin-1-yl)sulfonyl]piperidine-3-carbonyl}piperazine

E692-1567 Screening compound: 1-(5-chloro-2-methylphenyl)-4-{1-[(4-methylpiperidin-1-yl)sulfonyl]piperidine-3-carbonyl}piperazine
E692-1567 Screening compound: 1-(5-chloro-2-methylphenyl)-4-{1-[(4-methylpiperidin-1-yl)sulfonyl]piperidine-3-carbonyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E692-1567
1-(5-chloro-2-methylphenyl)-4-{1-[(4-methylpiperidin-1-yl)sulfonyl]piperidine-3-carbonyl}piperazine

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

E692-1567

Molecular Formula

C23H35ClN4O3S (C23 H35 ClN4 O3 S)

Compound Name

1-(5-chloro-2-methylphenyl)-4-{1-[(4-methylpiperidin-1-yl)sulfonyl]piperidine-3-carbonyl}piperazine

IUPAC name

1-(5-chloro-2-methylphenyl)-4-{1-[(4-methylpiperidin-1-yl)sulfonyl]piperidine-3-carbonyl}piperazine

SMILES

CC(CC1)CCN1S(N(CCC1)CC1C(N(CC1)CCN1c1c(C)ccc(Cl)c1)=O)(=O)=O

InChI

InChI=1S/C23H35ClN4O3S/c1-18-7-10-27(11-8-18)32(30,31)28-9-3-4-20(17-28)23(29)26-14-12-25(13-15-26)22-16-21(24)6-5-19(22)2/h5-6,16,18,20H,3-4,7-15,17H2,1-2H3/t20-/m0/s1

InChI Key

JWYGOQKGYWIPQO-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD14910481

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.07

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.622

Distribution Coefficient, logD

3.622

Water Solubility, LogSw

-3.87

Polar Surface Area

53.896

Acid Dissociation Constant (pKa)

22.98

Base Dissociation Constant (pKb)

2.45

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

69.60

E692-1567 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E692-1567 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E692-1567?
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What is the minimum amount of E692-1567 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E692-1567
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E692-1567
  • 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 E692-1567 available by request