D207-0273 Screening compound: 1-(1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)piperidine-3-carboxamide

D207-0273 Screening compound: 1-(1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)piperidine-3-carboxamide
D207-0273 Screening compound: 1-(1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D207-0273
1-(1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)piperidine-3-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

D207-0273

Molecular Formula

C21H23N3OS (C21 H23 N3 OS)

Compound Name

1-(1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)piperidine-3-carboxamide

IUPAC name

1-(13-benzothiazol-2-yl)-N-(24-dimethylphenyl)piperidine-3-carboxamide

SMILES

Cc(cc1)cc(C)c1NC(C(CCC1)CN1c1nc(cccc2)c2s1)=O

InChI

InChI=1S/C21H23N3OS/c1-14-9-10-17(15(2)12-14)22-20(25)16-6-5-11-24(13-16)21-23-18-7-3-4-8-19(18)26-21/h3-4,7-10,12,16H,5-6,11,13H2,1-2H3,(H,22,25)/t16-/m0/s1

InChI Key

VDLVRFITQBIHOH-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14814120

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.5

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.912

Distribution Coefficient, logD

4.912

Water Solubility, LogSw

-4.56

Polar Surface Area

35.553

Acid Dissociation Constant (pKa)

11.64

Base Dissociation Constant (pKb)

8.60

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

D207-0273 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with D207-0273 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D207-0273?
Check Price and Availability of D207-0273, 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 D207-0273 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D207-0273
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D207-0273
  • 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 D207-0273 available by request