K786-5589 Screening compound: N,N-DIMETHYL-N-(2-THIENYLMETHYL)TETRAHYDRO-1,4(2H)-PYRIDINEDICARBOXAMIDE

K786-5589 Screening compound: N,N-DIMETHYL-N-(2-THIENYLMETHYL)TETRAHYDRO-1,4(2H)-PYRIDINEDICARBOXAMIDE
K786-5589 Screening compound: N,N-DIMETHYL-N-(2-THIENYLMETHYL)TETRAHYDRO-1,4(2H)-PYRIDINEDICARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-5589
N,N-DIMETHYL-N-(2-THIENYLMETHYL)TETRAHYDRO-1,4(2H)-PYRIDINEDICARBOXAMIDE

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

K786-5589

Molecular Formula

C14H21N3O2S (C14 H21 N3 O2 S)

Compound Name

N,N-DIMETHYL-N-(2-THIENYLMETHYL)TETRAHYDRO-1,4(2H)-PYRIDINEDICARBOXAMIDE

IUPAC name

n/a

SMILES

CN(C)C(N(CC1)CCC1C(NCc1cccs1)=O)=O

InChI

InChI=1S/C14H21N3O2S/c1-16(2)14(19)17-7-5-11(6-8-17)13(18)15-10-12-4-3-9-20-12/h3-4,9,11H,5-8,10H2,1-2H3,(H,15,18)

InChI Key

CQMFOVQUSIYPNP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03832519

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

295.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.181

Distribution Coefficient, logD

1.181

Water Solubility, LogSw

-2.13

Polar Surface Area

43.476

Acid Dissociation Constant (pKa)

13.37

Base Dissociation Constant (pKb)

2.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

K786-5589 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with K786-5589 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-5589?
Check Price and Availability of K786-5589, 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 K786-5589 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-5589
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-5589
  • 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 K786-5589 available by request