G939-1691 Screening compound: 1-[2-methyl-4-(3-methyl-1,2-oxazol-5-yl)benzenesulfonyl]azepane

G939-1691 Screening compound: 1-[2-methyl-4-(3-methyl-1,2-oxazol-5-yl)benzenesulfonyl]azepane
G939-1691 Screening compound: 1-[2-methyl-4-(3-methyl-1,2-oxazol-5-yl)benzenesulfonyl]azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound G939-1691
1-[2-methyl-4-(3-methyl-1,2-oxazol-5-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

G939-1691

Molecular Formula

C17H22N2O3S (C17 H22 N2 O3 S)

Compound Name

1-[2-methyl-4-(3-methyl-1,2-oxazol-5-yl)benzenesulfonyl]azepane

IUPAC name

1-[2-methyl-4-(3-methyl-12-oxazol-5-yl)benzenesulfonyl]azepane

SMILES

Cc1noc(-c(cc2)cc(C)c2S(N2CCCCCC2)(=O)=O)c1

InChI

InChI=1S/C17H22N2O3S/c1-13-11-15(16-12-14(2)18-22-16)7-8-17(13)23(20,21)19-9-5-3-4-6-10-19/h7-8,11-12H,3-6,9-10H2,1-2H3

InChI Key

NNUFOYVIJIXRGN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27168815

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.44

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

3.562

Distribution Coefficient, logD

3.562

Water Solubility, LogSw

-3.62

Polar Surface Area

53.622

Acid Dissociation Constant (pKa)

26.75

Base Dissociation Constant (pKb)

-1.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.10

References: we are preparing a list of scientific research reports with G939-1691 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G939-1691?
Check Price and Availability of G939-1691, 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 G939-1691 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G939-1691
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G939-1691
  • 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 G939-1691 available by request