0988-0124 Screening compound: 3-iodo-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzamide

0988-0124 Screening compound: 3-iodo-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzamide
0988-0124 Screening compound: 3-iodo-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0988-0124
3-iodo-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzamide

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

0988-0124

Molecular Formula

C21H15IN2OS (C21 H15 IN2 OS)

Compound Name

3-iodo-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzamide

IUPAC name

3-iodo-N-[4-(6-methyl-13-benzothiazol-2-yl)phenyl]benzamide

SMILES

Cc(cc1)cc2c1nc(-c(cc1)ccc1NC(c1cccc(I)c1)=O)s2

InChI

InChI=1S/C21H15IN2OS/c1-13-5-10-18-19(11-13)26-21(24-18)14-6-8-17(9-7-14)23-20(25)15-3-2-4-16(22)12-15/h2-12H,1H3,(H,23,25)

InChI Key

YRRVRAVVPGYYRI-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.33

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.545

Distribution Coefficient, logD

6.545

Water Solubility, LogSw

-5.66

Polar Surface Area

32.779

Acid Dissociation Constant (pKa)

10.74

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

References: we are preparing a list of scientific research reports with 0988-0124 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0988-0124?
Check Price and Availability of 0988-0124, 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 0988-0124 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0988-0124
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0988-0124
  • 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 0988-0124 available by request