G863-0183 Screening compound: 4-(azepane-1-sulfonyl)-N-{[6-(4-methylphenyl)-2H,3H-imidazo[2,1-b][1,3]thiazol-5-yl]methyl}benzamide

G863-0183 Screening compound: 4-(azepane-1-sulfonyl)-N-{[6-(4-methylphenyl)-2H,3H-imidazo[2,1-b][1,3]thiazol-5-yl]methyl}benzamide
G863-0183 Screening compound: 4-(azepane-1-sulfonyl)-N-{[6-(4-methylphenyl)-2H,3H-imidazo[2,1-b][1,3]thiazol-5-yl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G863-0183
4-(azepane-1-sulfonyl)-N-{[6-(4-methylphenyl)-2H,3H-imidazo[2,1-b][1,3]thiazol-5-yl]methyl}benzamide

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

G863-0183

Molecular Formula

C26H30N4O3S2 (C26 H30 N4 O3 S2)

Compound Name

4-(azepane-1-sulfonyl)-N-{[6-(4-methylphenyl)-2H,3H-imidazo[2,1-b][1,3]thiazol-5-yl]methyl}benzamide

IUPAC name

4-(azepane-1-sulfonyl)-N-{[6-(4-methylphenyl)-2H3H-imidazo[21-b][13]thiazol-5-yl]methyl}benzamide

SMILES

Cc(cc1)ccc1-c1c(CNC(c(cc2)ccc2S(N2CCCCCC2)(=O)=O)=O)n(CCS2)c2n1

InChI

InChI=1S/C26H30N4O3S2/c1-19-6-8-20(9-7-19)24-23(30-16-17-34-26(30)28-24)18-27-25(31)21-10-12-22(13-11-21)35(32,33)29-14-4-2-3-5-15-29/h6-13H,2-5,14-18H2,1H3,(H,27,31)

InChI Key

JWJOJKCLUSBFEX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09238961

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

510.68

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.573

Distribution Coefficient, logD

4.477

Water Solubility, LogSw

-4.17

Polar Surface Area

67.674

Acid Dissociation Constant (pKa)

10.59

Base Dissociation Constant (pKb)

6.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

G863-0183 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G863-0183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G863-0183?
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What is the minimum amount of G863-0183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G863-0183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G863-0183
  • 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 G863-0183 available by request