K781-7782 Screening compound: ETHYL 1-{2-FLUORO-5-[(4-PHENOXYPHENYL)CARBAMOYL]BENZENESULFONYL}PIPERIDINE-3-CARBOXYLATE

K781-7782 Screening compound: ETHYL 1-{2-FLUORO-5-[(4-PHENOXYPHENYL)CARBAMOYL]BENZENESULFONYL}PIPERIDINE-3-CARBOXYLATE
K781-7782 Screening compound: ETHYL 1-{2-FLUORO-5-[(4-PHENOXYPHENYL)CARBAMOYL]BENZENESULFONYL}PIPERIDINE-3-CARBOXYLATE alternative view

Chemical Structure Depiction of ChemDiv screening compound K781-7782
ETHYL 1-{2-FLUORO-5-[(4-PHENOXYPHENYL)CARBAMOYL]BENZENESULFONYL}PIPERIDINE-3-CARBOXYLATE

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

K781-7782

Molecular Formula

C27H27FN2O6S (C27 H27 FN2 O6 S)

Compound Name

ETHYL 1-{2-FLUORO-5-[(4-PHENOXYPHENYL)CARBAMOYL]BENZENESULFONYL}PIPERIDINE-3-CARBOXYLATE

IUPAC name

n/a

SMILES

CCOC(C(CCC1)CN1S(c(cc(cc1)C(Nc(cc2)ccc2Oc2ccccc2)=O)c1F)(=O)=O)=O

InChI

InChI=1S/C27H27FN2O6S/c1-2-35-27(32)20-7-6-16-30(18-20)37(33,34)25-17-19(10-15-24(25)28)26(31)29-21-11-13-23(14-12-21)36-22-8-4-3-5-9-22/h3-5,8-15,17,20H,2,6-7,16,18H2,1H3,(H,29,31)/t20-/m0/s1

InChI Key

DHCHCTGUSCQDRP-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD15094839

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

526.59

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.933

Distribution Coefficient, logD

4.929

Water Solubility, LogSw

-4.54

Polar Surface Area

82.475

Acid Dissociation Constant (pKa)

9.47

Base Dissociation Constant (pKb)

-2.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with K781-7782 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K781-7782?
Check Price and Availability of K781-7782, 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 K781-7782 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K781-7782
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K781-7782
  • 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 K781-7782 available by request