D356-2087 Screening compound: 1,4-dimethyl 2-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-amido}benzene-1,4-dicarboxylate

D356-2087 Screening compound: 1,4-dimethyl 2-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-amido}benzene-1,4-dicarboxylate
D356-2087 Screening compound: 1,4-dimethyl 2-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-amido}benzene-1,4-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D356-2087
1,4-dimethyl 2-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-amido}benzene-1,4-dicarboxylate

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

D356-2087

Molecular Formula

C23H25FN2O7S (C23 H25 FN2 O7 S)

Compound Name

1,4-dimethyl 2-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-amido}benzene-1,4-dicarboxylate

IUPAC name

14-dimethyl 2-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-amido}benzene-14-dicarboxylate

SMILES

COC(c(cc1)cc(NC(C(CC2)CCN2S(Cc(cc2)ccc2F)(=O)=O)=O)c1C(OC)=O)=O

InChI

InChI=1S/C23H25FN2O7S/c1-32-22(28)17-5-8-19(23(29)33-2)20(13-17)25-21(27)16-9-11-26(12-10-16)34(30,31)14-15-3-6-18(24)7-4-15/h3-8,13,16H,9-12,14H2,1-2H3,(H,25,27)

InChI Key

JAKLOPCRYAADMS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14823966

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.53

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.488

Distribution Coefficient, logD

2.274

Water Solubility, LogSw

-3.03

Polar Surface Area

96.585

Acid Dissociation Constant (pKa)

7.60

Base Dissociation Constant (pKb)

-3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

References: we are preparing a list of scientific research reports with D356-2087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D356-2087?
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What is the minimum amount of D356-2087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D356-2087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D356-2087
  • 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 D356-2087 available by request