D356-1838 Screening compound: 1-{1-[(2-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}piperidine-4-carboxamide

D356-1838 Screening compound: 1-{1-[(2-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}piperidine-4-carboxamide
D356-1838 Screening compound: 1-{1-[(2-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D356-1838
1-{1-[(2-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}piperidine-4-carboxamide

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

D356-1838

Molecular Formula

C19H26FN3O4S (C19 H26 FN3 O4 S)

Compound Name

1-{1-[(2-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}piperidine-4-carboxamide

IUPAC name

1-{1-[(2-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}piperidine-4-carboxamide

SMILES

NC(C(CC1)CCN1C(C(CC1)CCN1S(Cc(cccc1)c1F)(=O)=O)=O)=O

InChI

InChI=1S/C19H26FN3O4S/c20-17-4-2-1-3-16(17)13-28(26,27)23-11-7-15(8-12-23)19(25)22-9-5-14(6-10-22)18(21)24/h1-4,14-15H,5-13H2,(H2,21,24)

InChI Key

GCNFFSNRKHQXQJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14823758

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.813

Distribution Coefficient, logD

0.813

Water Solubility, LogSw

-1.94

Polar Surface Area

82.551

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

1.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.90

D356-1838 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 D356-1838 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D356-1838?
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What is the minimum amount of D356-1838 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D356-1838
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D356-1838
  • 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 D356-1838 available by request