M086-0811 Screening compound: 1-(2-fluorophenyl)-4-{2-methoxy-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzenesulfonyl}piperazine

M086-0811 Screening compound: 1-(2-fluorophenyl)-4-{2-methoxy-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzenesulfonyl}piperazine
M086-0811 Screening compound: 1-(2-fluorophenyl)-4-{2-methoxy-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzenesulfonyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound M086-0811
1-(2-fluorophenyl)-4-{2-methoxy-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzenesulfonyl}piperazine

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

M086-0811

Molecular Formula

C21H19F4N3O4S (C21 H19 F4 N3 O4 S)

Compound Name

1-(2-fluorophenyl)-4-{2-methoxy-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzenesulfonyl}piperazine

IUPAC name

1-(2-fluorophenyl)-4-{2-methoxy-5-[5-(trifluoromethyl)-12-oxazol-3-yl]benzenesulfonyl}piperazine

SMILES

COc(ccc(-c1noc(C(F)(F)F)c1)c1)c1S(N(CC1)CCN1c(cccc1)c1F)(=O)=O

InChI

InChI=1S/C21H19F4N3O4S/c1-31-18-7-6-14(16-13-20(32-26-16)21(23,24)25)12-19(18)33(29,30)28-10-8-27(9-11-28)17-5-3-2-4-15(17)22/h2-7,12-13H,8-11H2,1H3

InChI Key

LFPYGHDUWSHYPI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15140611

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.514

Distribution Coefficient, logD

4.514

Water Solubility, LogSw

-4.33

Polar Surface Area

64.074

Acid Dissociation Constant (pKa)

27.94

Base Dissociation Constant (pKb)

4.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with M086-0811 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M086-0811?
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What is the minimum amount of M086-0811 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M086-0811
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M086-0811
  • 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 M086-0811 available by request