V016-9827 Screening compound: 2-[(2,5-dichlorophenoxy)methyl]-N-[(pyridin-4-yl)methyl]-1,3-thiazole-4-carboxamide

V016-9827 Screening compound: 2-[(2,5-dichlorophenoxy)methyl]-N-[(pyridin-4-yl)methyl]-1,3-thiazole-4-carboxamide
V016-9827 Screening compound: 2-[(2,5-dichlorophenoxy)methyl]-N-[(pyridin-4-yl)methyl]-1,3-thiazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-9827
2-[(2,5-dichlorophenoxy)methyl]-N-[(pyridin-4-yl)methyl]-1,3-thiazole-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

V016-9827

Molecular Formula

C17H13Cl2N3O2S (C17 H13 Cl2 N3 O2 S)

Compound Name

2-[(2,5-dichlorophenoxy)methyl]-N-[(pyridin-4-yl)methyl]-1,3-thiazole-4-carboxamide

IUPAC name

2-[(25-dichlorophenoxy)methyl]-N-[(pyridin-4-yl)methyl]-13-thiazole-4-carboxamide

SMILES

O=C(c1csc(COc(cc(cc2)Cl)c2Cl)n1)NCc1ccncc1

InChI

InChI=1S/C17H13Cl2N3O2S/c18-12-1-2-13(19)15(7-12)24-9-16-22-14(10-25-16)17(23)21-8-11-3-5-20-6-4-11/h1-7,10H,8-9H2,(H,21,23)

InChI Key

YKRKZXLITOVLSR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19837976

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

394.28

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.826

Distribution Coefficient, logD

3.823

Water Solubility, LogSw

-4.33

Polar Surface Area

51.895

Acid Dissociation Constant (pKa)

13.07

Base Dissociation Constant (pKb)

5.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

V016-9827 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Infections
  • Immune system
  • animal
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V016-9827 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-9827?
Check Price and Availability of V016-9827, 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 V016-9827 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-9827
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-9827
  • 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 V016-9827 available by request