G588-0212 Screening compound: ethyl 2-{4-[({4H,5H,6H,7H,8H-cyclohepta[d][1,3]thiazol-2-yl}carbamoyl)amino]phenyl}acetate

G588-0212 Screening compound: ethyl 2-{4-[({4H,5H,6H,7H,8H-cyclohepta[d][1,3]thiazol-2-yl}carbamoyl)amino]phenyl}acetate
G588-0212 Screening compound: ethyl 2-{4-[({4H,5H,6H,7H,8H-cyclohepta[d][1,3]thiazol-2-yl}carbamoyl)amino]phenyl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound G588-0212
ethyl 2-{4-[({4H,5H,6H,7H,8H-cyclohepta[d][1,3]thiazol-2-yl}carbamoyl)amino]phenyl}acetate

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

G588-0212

Molecular Formula

C19H23N3O3S (C19 H23 N3 O3 S)

Compound Name

ethyl 2-{4-[({4H,5H,6H,7H,8H-cyclohepta[d][1,3]thiazol-2-yl}carbamoyl)amino]phenyl}acetate

IUPAC name

ethyl 2-{4-[({4H5H6H7H8H-cyclohepta[d][13]thiazol-2-yl}carbamoyl)amino]phenyl}acetate

SMILES

CCOC(Cc(cc1)ccc1NC(Nc1nc(CCCCC2)c2s1)=O)=O

InChI

InChI=1S/C19H23N3O3S/c1-2-25-17(23)12-13-8-10-14(11-9-13)20-18(24)22-19-21-15-6-4-3-5-7-16(15)26-19/h8-11H,2-7,12H2,1H3,(H2,20,21,22,24)

InChI Key

NBEYISYSJHYNBI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15021513

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.818

Distribution Coefficient, logD

4.807

Water Solubility, LogSw

-4.31

Polar Surface Area

64.499

Acid Dissociation Constant (pKa)

9.04

Base Dissociation Constant (pKb)

4.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

G588-0212 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anticancer Library (62698 compounds)

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G588-0212 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G588-0212?
Check Price and Availability of G588-0212, 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 G588-0212 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G588-0212
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G588-0212
  • 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 G588-0212 available by request