G847-0061 Screening compound: 1-[4-(2-methyl-1,3-oxazol-4-yl)benzenesulfonyl]azepane

G847-0061 Screening compound: 1-[4-(2-methyl-1,3-oxazol-4-yl)benzenesulfonyl]azepane
G847-0061 Screening compound: 1-[4-(2-methyl-1,3-oxazol-4-yl)benzenesulfonyl]azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound G847-0061
1-[4-(2-methyl-1,3-oxazol-4-yl)benzenesulfonyl]azepane

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

G847-0061

Molecular Formula

C16H20N2O3S (C16 H20 N2 O3 S)

Compound Name

1-[4-(2-methyl-1,3-oxazol-4-yl)benzenesulfonyl]azepane

IUPAC name

1-[4-(2-methyl-13-oxazol-4-yl)benzenesulfonyl]azepane

SMILES

Cc1nc(-c(cc2)ccc2S(N2CCCCCC2)(=O)=O)co1

InChI

InChI=1S/C16H20N2O3S/c1-13-17-16(12-21-13)14-6-8-15(9-7-14)22(19,20)18-10-4-2-3-5-11-18/h6-9,12H,2-5,10-11H2,1H3

InChI Key

LOXPCIXABNVTJA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15039893

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.229

Distribution Coefficient, logD

3.229

Water Solubility, LogSw

-3.42

Polar Surface Area

49.977

Acid Dissociation Constant (pKa)

27.74

Base Dissociation Constant (pKb)

0.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.75

G847-0061 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G847-0061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G847-0061?
Check Price and Availability of G847-0061, 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 G847-0061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G847-0061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G847-0061
  • 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 G847-0061 available by request