7418-0603 Screening compound: N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-5-chloro-2-methoxybenzamide

7418-0603 Screening compound: N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-5-chloro-2-methoxybenzamide
7418-0603 Screening compound: N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-5-chloro-2-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7418-0603
N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-5-chloro-2-methoxybenzamide

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

7418-0603

Molecular Formula

C22H17ClN2O3S (C22 H17 ClN2 O3 S)

Compound Name

N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-5-chloro-2-methoxybenzamide

IUPAC name

N-[5-(13-benzothiazol-2-yl)-2-methoxyphenyl]-5-chloro-2-methoxybenzamide

SMILES

COc(ccc(Cl)c1)c1C(Nc(cc(cc1)-c2nc(cccc3)c3s2)c1OC)=O

InChI

InChI=1S/C22H17ClN2O3S/c1-27-18-10-8-14(23)12-15(18)21(26)24-17-11-13(7-9-19(17)28-2)22-25-16-5-3-4-6-20(16)29-22/h3-12H,1-2H3,(H,24,26)

InChI Key

UHWYOZOZSQBJFO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05819551

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.91

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.766

Distribution Coefficient, logD

5.684

Water Solubility, LogSw

-5.92

Polar Surface Area

47.342

Acid Dissociation Constant (pKa)

8.08

Base Dissociation Constant (pKb)

-0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

7418-0603 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Human Proteases Annotated Library (2868 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 7418-0603 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7418-0603?
Check Price and Availability of 7418-0603, 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 7418-0603 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7418-0603
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7418-0603
  • 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 7418-0603 available by request