0831-0161 Screening compound: (E)-1-(2,4-dimethoxyphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]methanimine

0831-0161 Screening compound: (E)-1-(2,4-dimethoxyphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]methanimine
0831-0161 Screening compound: (E)-1-(2,4-dimethoxyphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]methanimine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0831-0161
(E)-1-(2,4-dimethoxyphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]methanimine

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

0831-0161

Molecular Formula

C23H20N2O2S (C23 H20 N2 O2 S)

Compound Name

(E)-1-(2,4-dimethoxyphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]methanimine

IUPAC name

(E)-1-(24-dimethoxyphenyl)-N-[4-(6-methyl-13-benzothiazol-2-yl)phenyl]methanimine

SMILES

Cc(cc1)cc2c1nc(-c(cc1)ccc1/N=C/c(ccc(OC)c1)c1OC)s2

InChI

InChI=1S/C23H20N2O2S/c1-15-4-11-20-22(12-15)28-23(25-20)16-5-8-18(9-6-16)24-14-17-7-10-19(26-2)13-21(17)27-3/h4-14H,1-3H3

InChI Key

ALJRTBFGHHFTES-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00992643

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.919

Distribution Coefficient, logD

5.917

Water Solubility, LogSw

-5.62

Polar Surface Area

32.989

Acid Dissociation Constant (pKa)

27.11

Base Dissociation Constant (pKb)

4.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

References: we are preparing a list of scientific research reports with 0831-0161 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0831-0161?
Check Price and Availability of 0831-0161, 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 0831-0161 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0831-0161
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0831-0161
  • 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 0831-0161 available by request