G786-1540 Screening compound: methyl 4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate

G786-1540 Screening compound: methyl 4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate
G786-1540 Screening compound: methyl 4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G786-1540
methyl 4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate

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

G786-1540

Molecular Formula

C16H13N3O5S2 (C16 H13 N3 O5 S2)

Compound Name

methyl 4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate

IUPAC name

methyl 4-[(6-sulfamoyl-13-benzothiazol-2-yl)carbamoyl]benzoate

SMILES

COC(c(cc1)ccc1C(Nc1nc(ccc(S(N)(=O)=O)c2)c2s1)=O)=O

InChI

InChI=1S/C16H13N3O5S2/c1-24-15(21)10-4-2-9(3-5-10)14(20)19-16-18-12-7-6-11(26(17,22)23)8-13(12)25-16/h2-8H,1H3,(H2,17,22,23)(H,18,19,20)

InChI Key

QMEUCPKZAHZDCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05034706

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.43

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.590

Distribution Coefficient, logD

2.583

Water Solubility, LogSw

-3.40

Polar Surface Area

104.868

Acid Dissociation Constant (pKa)

9.18

Base Dissociation Constant (pKb)

-3.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

G786-1540 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-Aging Library (44940 compounds)

Carbonic Anhydrase II Library (4939 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Kinases
  • Phosphatases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G786-1540 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G786-1540?
Check Price and Availability of G786-1540, 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 G786-1540 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G786-1540
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G786-1540
  • 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 G786-1540 available by request