G786-1597 Screening compound: N-[6-(morpholine-4-sulfonyl)-1,3-benzothiazol-2-yl]quinoline-2-carboxamide

G786-1597 Screening compound: N-[6-(morpholine-4-sulfonyl)-1,3-benzothiazol-2-yl]quinoline-2-carboxamide
G786-1597 Screening compound: N-[6-(morpholine-4-sulfonyl)-1,3-benzothiazol-2-yl]quinoline-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G786-1597
N-[6-(morpholine-4-sulfonyl)-1,3-benzothiazol-2-yl]quinoline-2-carboxamide

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

G786-1597

Molecular Formula

C21H18N4O4S2 (C21 H18 N4 O4 S2)

Compound Name

N-[6-(morpholine-4-sulfonyl)-1,3-benzothiazol-2-yl]quinoline-2-carboxamide

IUPAC name

N-[6-(morpholine-4-sulfonyl)-13-benzothiazol-2-yl]quinoline-2-carboxamide

SMILES

O=C(c1nc2ccccc2cc1)Nc1nc(ccc(S(N2CCOCC2)(=O)=O)c2)c2s1

InChI

InChI=1S/C21H18N4O4S2/c26-20(18-7-5-14-3-1-2-4-16(14)22-18)24-21-23-17-8-6-15(13-19(17)30-21)31(27,28)25-9-11-29-12-10-25/h1-8,13H,9-12H2,(H,23,24,26)

InChI Key

RVAZXYNKQKGYRN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04164560

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.53

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.651

Distribution Coefficient, logD

3.646

Water Solubility, LogSw

-4.06

Polar Surface Area

81.041

Acid Dissociation Constant (pKa)

9.30

Base Dissociation Constant (pKb)

-0.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

G786-1597 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-infective Library (19449 compounds)

Anticancer Library (62698 compounds)

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

Nucleic Acid Ligands (8311 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Immune system
  • animal
  • Cancer
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Kinases
  • Phosphatases

References: we are preparing a list of scientific research reports with G786-1597 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G786-1597?
Check Price and Availability of G786-1597, 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 G786-1597 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G786-1597
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G786-1597
  • 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 G786-1597 available by request