C858-1735 Screening compound: 6-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-2-(morpholin-4-yl)-1,3-benzothiazole

C858-1735 Screening compound: 6-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-2-(morpholin-4-yl)-1,3-benzothiazole
C858-1735 Screening compound: 6-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-2-(morpholin-4-yl)-1,3-benzothiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound C858-1735
6-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-2-(morpholin-4-yl)-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

C858-1735

Molecular Formula

C24H28N4O2S (C24 H28 N4 O2 S)

Compound Name

6-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-2-(morpholin-4-yl)-1,3-benzothiazole

IUPAC name

6-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-2-(morpholin-4-yl)-13-benzothiazole

SMILES

CC(CN(CC1)C(c(cc2)cc3c2nc(N2CCOCC2)s3)=O)N1c1cc(C)ccc1

InChI

InChI=1S/C24H28N4O2S/c1-17-4-3-5-20(14-17)28-9-8-27(16-18(28)2)23(29)19-6-7-21-22(15-19)31-24(25-21)26-10-12-30-13-11-26/h3-7,14-15,18H,8-13,16H2,1-2H3/t18-/m0/s1

InChI Key

KEGJDMLQIZEHMI-SFHVURJKSA-N

MDL Number (MFCD)

MFCD14801564

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.133

Distribution Coefficient, logD

4.133

Water Solubility, LogSw

-4.19

Polar Surface Area

40.262

Acid Dissociation Constant (pKa)

23.49

Base Dissociation Constant (pKb)

7.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

C858-1735 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with C858-1735 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C858-1735?
Check Price and Availability of C858-1735, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C858-1735 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C858-1735
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C858-1735
  • 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 C858-1735 available by request