D356-0679 Screening compound: N-[3-(1H-imidazol-1-yl)propyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide

D356-0679 Screening compound: N-[3-(1H-imidazol-1-yl)propyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide
D356-0679 Screening compound: N-[3-(1H-imidazol-1-yl)propyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D356-0679
N-[3-(1H-imidazol-1-yl)propyl]-1-[(2-methylphenyl)methanesulfonyl]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

D356-0679

Molecular Formula

C20H28N4O3S (C20 H28 N4 O3 S)

Compound Name

N-[3-(1H-imidazol-1-yl)propyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide

IUPAC name

N-[3-(1H-imidazol-1-yl)propyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide

SMILES

Cc1c(CS(N(CC2)CCC2C(NCCCn2cncc2)=O)(=O)=O)cccc1

InChI

InChI=1S/C20H28N4O3S/c1-17-5-2-3-6-19(17)15-28(26,27)24-12-7-18(8-13-24)20(25)22-9-4-11-23-14-10-21-16-23/h2-3,5-6,10,14,16,18H,4,7-9,11-13,15H2,1H3,(H,22,25)

InChI Key

LJZJQBLLPLFAMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14822830

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.522

Distribution Coefficient, logD

1.280

Water Solubility, LogSw

-2.04

Polar Surface Area

68.899

Acid Dissociation Constant (pKa)

14.62

Base Dissociation Constant (pKb)

7.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

D356-0679 in Drug Discovery

Included in Screening Libraries

Proline Kinase Library (2105 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D356-0679 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D356-0679?
Check Price and Availability of D356-0679, 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 D356-0679 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D356-0679
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D356-0679
  • 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 D356-0679 available by request