G588-0309 Screening compound: 3-{4H,5H,6H,7H,8H,9H-cycloocta[d][1,3]thiazol-2-yl}-1-(2,4-dimethoxyphenyl)urea

G588-0309 Screening compound: 3-{4H,5H,6H,7H,8H,9H-cycloocta[d][1,3]thiazol-2-yl}-1-(2,4-dimethoxyphenyl)urea
G588-0309 Screening compound: 3-{4H,5H,6H,7H,8H,9H-cycloocta[d][1,3]thiazol-2-yl}-1-(2,4-dimethoxyphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound G588-0309
3-{4H,5H,6H,7H,8H,9H-cycloocta[d][1,3]thiazol-2-yl}-1-(2,4-dimethoxyphenyl)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

G588-0309

Molecular Formula

C18H23N3O3S (C18 H23 N3 O3 S)

Compound Name

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

IUPAC name

3-{4H5H6H7H8H9H-cycloocta[d][13]thiazol-2-yl}-1-(24-dimethoxyphenyl)urea

SMILES

COc(cc1)cc(OC)c1NC(Nc1nc(CCCCCC2)c2s1)=O

InChI

InChI=1S/C18H23N3O3S/c1-23-12-9-10-13(15(11-12)24-2)19-17(22)21-18-20-14-7-5-3-4-6-8-16(14)25-18/h9-11H,3-8H2,1-2H3,(H2,19,20,21,22)

InChI Key

SSWYBGINDLUQGW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15021544

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.005

Distribution Coefficient, logD

5.002

Water Solubility, LogSw

-4.61

Polar Surface Area

58.817

Acid Dissociation Constant (pKa)

9.65

Base Dissociation Constant (pKb)

4.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

G588-0309 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with G588-0309 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G588-0309?
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What is the minimum amount of G588-0309 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G588-0309
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G588-0309
  • 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 G588-0309 available by request