6557-0041 Screening compound: methyl 2-{[(4E)-2-(4-methoxyphenyl)-4-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)imino]-4H-chromen-6-yl]oxy}acetate

6557-0041 Screening compound: methyl 2-{[(4E)-2-(4-methoxyphenyl)-4-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)imino]-4H-chromen-6-yl]oxy}acetate
6557-0041 Screening compound: methyl 2-{[(4E)-2-(4-methoxyphenyl)-4-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)imino]-4H-chromen-6-yl]oxy}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6557-0041
methyl 2-{[(4E)-2-(4-methoxyphenyl)-4-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)imino]-4H-chromen-6-yl]oxy}acetate

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

6557-0041

Molecular Formula

C29H24N2O5S (C29 H24 N2 O5 S)

Compound Name

methyl 2-{[(4E)-2-(4-methoxyphenyl)-4-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)imino]-4H-chromen-6-yl]oxy}acetate

IUPAC name

methyl 2-{[(4E)-2-(4-methoxyphenyl)-4-[(5-methyl-4-phenyl-13-thiazol-2-yl)imino]-4H-chromen-6-yl]oxy}acetate

SMILES

Cc1c(-c2ccccc2)nc(/N=C2/c(cc(cc3)OCC(OC)=O)c3OC(c(cc3)ccc3OC)=C2)s1

InChI

InChI=1S/C29H24N2O5S/c1-18-28(20-7-5-4-6-8-20)31-29(37-18)30-24-16-26(19-9-11-21(33-2)12-10-19)36-25-14-13-22(15-23(24)25)35-17-27(32)34-3/h4-16H,17H2,1-3H3

InChI Key

WUQVISWDFLJLHO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04192437

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

512.59

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.450

Distribution Coefficient, logD

5.515

Water Solubility, LogSw

-5.76

Polar Surface Area

62.175

Acid Dissociation Constant (pKa)

24.27

Base Dissociation Constant (pKb)

8.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.80

References: we are preparing a list of scientific research reports with 6557-0041 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6557-0041?
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What is the minimum amount of 6557-0041 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6557-0041
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6557-0041
  • 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 6557-0041 available by request