C583-0150 Screening compound: 2-METHYL-N-{4-METHYL-1-OXO-1-[4-(PYRIDIN-2-YL)PIPERAZIN-1-YL]PENTAN-2-YL}-1,3-BENZOTHIAZOLE-6-SULFONAMIDE

C583-0150 Screening compound: 2-METHYL-N-{4-METHYL-1-OXO-1-[4-(PYRIDIN-2-YL)PIPERAZIN-1-YL]PENTAN-2-YL}-1,3-BENZOTHIAZOLE-6-SULFONAMIDE
C583-0150 Screening compound: 2-METHYL-N-{4-METHYL-1-OXO-1-[4-(PYRIDIN-2-YL)PIPERAZIN-1-YL]PENTAN-2-YL}-1,3-BENZOTHIAZOLE-6-SULFONAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C583-0150
2-METHYL-N-{4-METHYL-1-OXO-1-[4-(PYRIDIN-2-YL)PIPERAZIN-1-YL]PENTAN-2-YL}-1,3-BENZOTHIAZOLE-6-SULFONAMIDE

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

C583-0150

Molecular Formula

C23H29N5O3S2 (C23 H29 N5 O3 S2)

Compound Name

2-METHYL-N-{4-METHYL-1-OXO-1-[4-(PYRIDIN-2-YL)PIPERAZIN-1-YL]PENTAN-2-YL}-1,3-BENZOTHIAZOLE-6-SULFONAMIDE

IUPAC name

n/a

SMILES

CC(C)CC(C(N(CC1)CCN1c1ncccc1)=O)NS(c(cc1)cc2c1nc(C)s2)(=O)=O

InChI

InChI=1S/C23H29N5O3S2/c1-16(2)14-20(23(29)28-12-10-27(11-13-28)22-6-4-5-9-24-22)26-33(30,31)18-7-8-19-21(15-18)32-17(3)25-19/h4-9,15-16,20,26H,10-14H2,1-3H3/t20-/m0/s1

InChI Key

APELGKDLIQGOBE-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD14772933

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.65

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.067

Distribution Coefficient, logD

4.058

Water Solubility, LogSw

-4.10

Polar Surface Area

80.059

Acid Dissociation Constant (pKa)

10.56

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.50

C583-0150 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C583-0150 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C583-0150?
Check Price and Availability of C583-0150, 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 C583-0150 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C583-0150
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C583-0150
  • 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 C583-0150 available by request