G708-0180 Screening compound: 3-[(4-fluorophenyl)methoxy]-1-[2-(trifluoromethyl)benzenesulfonyl]azetidine

G708-0180 Screening compound: 3-[(4-fluorophenyl)methoxy]-1-[2-(trifluoromethyl)benzenesulfonyl]azetidine
G708-0180 Screening compound: 3-[(4-fluorophenyl)methoxy]-1-[2-(trifluoromethyl)benzenesulfonyl]azetidine alternative view

Chemical Structure Depiction of ChemDiv screening compound G708-0180
3-[(4-fluorophenyl)methoxy]-1-[2-(trifluoromethyl)benzenesulfonyl]azetidine

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

G708-0180

Molecular Formula

C17H15F4NO3S (C17 H15 F4 NO3 S)

Compound Name

3-[(4-fluorophenyl)methoxy]-1-[2-(trifluoromethyl)benzenesulfonyl]azetidine

IUPAC name

3-[(4-fluorophenyl)methoxy]-1-[2-(trifluoromethyl)benzenesulfonyl]azetidine

SMILES

O=S(c1c(C(F)(F)F)cccc1)(N(C1)CC1OCc(cc1)ccc1F)=O

InChI

InChI=1S/C17H15F4NO3S/c18-13-7-5-12(6-8-13)11-25-14-9-22(10-14)26(23,24)16-4-2-1-3-15(16)17(19,20)21/h1-8,14H,9-11H2

InChI Key

XULBYFXQEBTVPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27153013

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.397

Distribution Coefficient, logD

3.397

Water Solubility, LogSw

-3.87

Polar Surface Area

38.889

Acid Dissociation Constant (pKa)

25.05

Base Dissociation Constant (pKb)

-6.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

G708-0180 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G708-0180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G708-0180?
Check Price and Availability of G708-0180, 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 G708-0180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G708-0180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G708-0180
  • 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 G708-0180 available by request