G588-0269 Screening compound: 1-(4-chlorophenyl)-3-{4H,5H,6H,7H,8H,9H-cycloocta[d][1,3]thiazol-2-yl}urea

G588-0269 Screening compound: 1-(4-chlorophenyl)-3-{4H,5H,6H,7H,8H,9H-cycloocta[d][1,3]thiazol-2-yl}urea
G588-0269 Screening compound: 1-(4-chlorophenyl)-3-{4H,5H,6H,7H,8H,9H-cycloocta[d][1,3]thiazol-2-yl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound G588-0269
1-(4-chlorophenyl)-3-{4H,5H,6H,7H,8H,9H-cycloocta[d][1,3]thiazol-2-yl}urea

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

G588-0269

Molecular Formula

C16H18ClN3OS (C16 H18 ClN3 OS)

Compound Name

1-(4-chlorophenyl)-3-{4H,5H,6H,7H,8H,9H-cycloocta[d][1,3]thiazol-2-yl}urea

IUPAC name

1-(4-chlorophenyl)-3-{4H5H6H7H8H9H-cycloocta[d][13]thiazol-2-yl}urea

SMILES

O=C(Nc1nc(CCCCCC2)c2s1)Nc(cc1)ccc1Cl

InChI

InChI=1S/C16H18ClN3OS/c17-11-7-9-12(10-8-11)18-15(21)20-16-19-13-5-3-1-2-4-6-14(13)22-16/h7-10H,1-6H2,(H2,18,19,20,21)

InChI Key

XICHTJKMAPIQQN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15021525

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.86

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.853

Distribution Coefficient, logD

5.843

Water Solubility, LogSw

-6.11

Polar Surface Area

44.340

Acid Dissociation Constant (pKa)

9.04

Base Dissociation Constant (pKb)

4.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

G588-0269 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer

References: we are preparing a list of scientific research reports with G588-0269 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G588-0269?
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What is the minimum amount of G588-0269 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G588-0269
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G588-0269
  • 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 G588-0269 available by request