G786-0911 Screening compound: 4-[(dimethylamino)sulfonyl]-N~1~-[1,3]dioxolo[4,5-f][1,3]benzothiazol-6-ylbenzamide

G786-0911 Screening compound: 4-[(dimethylamino)sulfonyl]-N~1~-[1,3]dioxolo[4,5-f][1,3]benzothiazol-6-ylbenzamide
G786-0911 Screening compound: 4-[(dimethylamino)sulfonyl]-N~1~-[1,3]dioxolo[4,5-f][1,3]benzothiazol-6-ylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G786-0911
4-[(dimethylamino)sulfonyl]-N~1~-[1,3]dioxolo[4,5-f][1,3]benzothiazol-6-ylbenzamide

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

G786-0911

Molecular Formula

C17H15N3O5S2 (C17 H15 N3 O5 S2)

Compound Name

4-[(dimethylamino)sulfonyl]-N~1~-[1,3]dioxolo[4,5-f][1,3]benzothiazol-6-ylbenzamide

IUPAC name

4-(dimethylsulfamoyl)-N-{46-dioxa-10-thia-12-azatricyclo[7.3.0.0^{37}]dodeca-1(9)2711-tetraen-11-yl}benzamide

SMILES

CN(C)S(c(cc1)ccc1C(Nc1nc(cc2OCOc2c2)c2s1)=O)(=O)=O

InChI

InChI=1S/C17H15N3O5S2/c1-20(2)27(22,23)11-5-3-10(4-6-11)16(21)19-17-18-12-7-13-14(25-9-24-13)8-15(12)26-17/h3-8H,9H2,1-2H3,(H,18,19,21)

InChI Key

LPHAMSXPIPWDEY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05924647

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.46

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

3.074

Distribution Coefficient, logD

3.073

Water Solubility, LogSw

-3.58

Polar Surface Area

83.870

Acid Dissociation Constant (pKa)

9.92

Base Dissociation Constant (pKb)

1.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

G786-0911 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-Aging Library (44940 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G786-0911 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G786-0911?
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What is the minimum amount of G786-0911 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G786-0911
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G786-0911
  • 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 G786-0911 available by request