6557-0027 Screening compound: 4-[(4E)-4-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)imino]-4H-chromen-2-yl]phenol

6557-0027 Screening compound: 4-[(4E)-4-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)imino]-4H-chromen-2-yl]phenol
6557-0027 Screening compound: 4-[(4E)-4-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)imino]-4H-chromen-2-yl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 6557-0027
4-[(4E)-4-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)imino]-4H-chromen-2-yl]phenol

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

6557-0027

Molecular Formula

C25H18N2O2S (C25 H18 N2 O2 S)

Compound Name

4-[(4E)-4-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)imino]-4H-chromen-2-yl]phenol

IUPAC name

4-[(4E)-4-[(5-methyl-4-phenyl-13-thiazol-2-yl)imino]-4H-chromen-2-yl]phenol

SMILES

Cc1c(-c2ccccc2)nc(/N=C2/c(cccc3)c3OC(c(cc3)ccc3O)=C2)s1

InChI

InChI=1S/C25H18N2O2S/c1-16-24(18-7-3-2-4-8-18)27-25(30-16)26-21-15-23(17-11-13-19(28)14-12-17)29-22-10-6-5-9-20(21)22/h2-15,28H,1H3

InChI Key

ZJSIOWXKCYEGBF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04172865

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.447

Distribution Coefficient, logD

6.000

Water Solubility, LogSw

-5.85

Polar Surface Area

44.170

Acid Dissociation Constant (pKa)

10.54

Base Dissociation Constant (pKb)

7.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

6557-0027 in Drug Discovery

Included in Screening Libraries

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6557-0027 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6557-0027?
Check Price and Availability of 6557-0027, 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 6557-0027 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6557-0027
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6557-0027
  • 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 6557-0027 available by request