C782-1097 Screening compound: 2-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]piperidin-1-yl}-4,6-dimethyl-1,3-benzothiazole

C782-1097 Screening compound: 2-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]piperidin-1-yl}-4,6-dimethyl-1,3-benzothiazole
C782-1097 Screening compound: 2-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]piperidin-1-yl}-4,6-dimethyl-1,3-benzothiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound C782-1097
2-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]piperidin-1-yl}-4,6-dimethyl-1,3-benzothiazole

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

C782-1097

Molecular Formula

C26H31ClN4OS (C26 H31 ClN4 OS)

Compound Name

2-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]piperidin-1-yl}-4,6-dimethyl-1,3-benzothiazole

IUPAC name

2-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]piperidin-1-yl}-46-dimethyl-13-benzothiazole

SMILES

Cc(cc1C)cc2c1nc(N(CC1)CCC1C(N(CC1)CCN1c1c(C)ccc(Cl)c1)=O)s2

InChI

InChI=1S/C26H31ClN4OS/c1-17-14-19(3)24-23(15-17)33-26(28-24)31-8-6-20(7-9-31)25(32)30-12-10-29(11-13-30)22-16-21(27)5-4-18(22)2/h4-5,14-16,20H,6-13H2,1-3H3

InChI Key

SHHAVRMWRQIOBG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14794039

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.08

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.542

Distribution Coefficient, logD

6.541

Water Solubility, LogSw

-6.27

Polar Surface Area

33.604

Acid Dissociation Constant (pKa)

21.91

Base Dissociation Constant (pKb)

5.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

C782-1097 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with C782-1097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C782-1097?
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What is the minimum amount of C782-1097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C782-1097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C782-1097
  • 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 C782-1097 available by request