C436-0417 Screening compound: N-(3,5-dimethylphenyl)-1-(3-pyridylsulfonyl)-3-piperidinecarboxamide

C436-0417 Screening compound: N-(3,5-dimethylphenyl)-1-(3-pyridylsulfonyl)-3-piperidinecarboxamide
C436-0417 Screening compound: N-(3,5-dimethylphenyl)-1-(3-pyridylsulfonyl)-3-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C436-0417
N-(3,5-dimethylphenyl)-1-(3-pyridylsulfonyl)-3-piperidinecarboxamide

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

C436-0417

Molecular Formula

C19H23N3O3S (C19 H23 N3 O3 S)

Compound Name

N-(3,5-dimethylphenyl)-1-(3-pyridylsulfonyl)-3-piperidinecarboxamide

IUPAC name

N-(35-dimethylphenyl)-1-(pyridine-3-sulfonyl)piperidine-3-carboxamide

SMILES

Cc1cc(NC(C(CCC2)CN2S(c2cnccc2)(=O)=O)=O)cc(C)c1

InChI

InChI=1S/C19H23N3O3S/c1-14-9-15(2)11-17(10-14)21-19(23)16-5-4-8-22(13-16)26(24,25)18-6-3-7-20-12-18/h3,6-7,9-12,16H,4-5,8,13H2,1-2H3,(H,21,23)/t16-/m0/s1

InChI Key

PZRWESLMZZRZCY-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14757734

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.217

Distribution Coefficient, logD

2.217

Water Solubility, LogSw

-2.46

Polar Surface Area

64.492

Acid Dissociation Constant (pKa)

11.82

Base Dissociation Constant (pKb)

-0.25

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.84

C436-0417 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C436-0417 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C436-0417?
Check Price and Availability of C436-0417, 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 C436-0417 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C436-0417
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C436-0417
  • 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 C436-0417 available by request