G645-0037 Screening compound: 2-(4-chlorophenoxy)-N-(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl)acetamide

G645-0037 Screening compound: 2-(4-chlorophenoxy)-N-(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl)acetamide
G645-0037 Screening compound: 2-(4-chlorophenoxy)-N-(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G645-0037
2-(4-chlorophenoxy)-N-(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl)acetamide

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

G645-0037

Molecular Formula

C16H13ClN2O3S (C16 H13 ClN2 O3 S)

Compound Name

2-(4-chlorophenoxy)-N-(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl)acetamide

IUPAC name

2-(4-chlorophenoxy)-N-(3-methyl-2-oxo-23-dihydro-13-benzothiazol-6-yl)acetamide

SMILES

CN(c(ccc(NC(COc(cc1)ccc1Cl)=O)c1)c1S1)C1=O

InChI

InChI=1S/C16H13ClN2O3S/c1-19-13-7-4-11(8-14(13)23-16(19)21)18-15(20)9-22-12-5-2-10(17)3-6-12/h2-8H,9H2,1H3,(H,18,20)

InChI Key

RLFCISFINQBFBK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15025788

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.81

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.891

Distribution Coefficient, logD

3.891

Water Solubility, LogSw

-4.36

Polar Surface Area

46.225

Acid Dissociation Constant (pKa)

11.89

Base Dissociation Constant (pKb)

-0.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

G645-0037 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with G645-0037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G645-0037?
Check Price and Availability of G645-0037, 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 G645-0037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G645-0037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G645-0037
  • 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 G645-0037 available by request