6737-1398 Screening compound: ethyl 7-[(4-fluorophenyl)methoxy]-3-(4-methoxyphenyl)-4-oxo-4H-chromene-2-carboxylate

6737-1398 Screening compound: ethyl 7-[(4-fluorophenyl)methoxy]-3-(4-methoxyphenyl)-4-oxo-4H-chromene-2-carboxylate
6737-1398 Screening compound: ethyl 7-[(4-fluorophenyl)methoxy]-3-(4-methoxyphenyl)-4-oxo-4H-chromene-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6737-1398
ethyl 7-[(4-fluorophenyl)methoxy]-3-(4-methoxyphenyl)-4-oxo-4H-chromene-2-carboxylate

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

6737-1398

Molecular Formula

C26H21FO6 (C26 H21 FO6)

Compound Name

ethyl 7-[(4-fluorophenyl)methoxy]-3-(4-methoxyphenyl)-4-oxo-4H-chromene-2-carboxylate

IUPAC name

ethyl 7-[(4-fluorophenyl)methoxy]-3-(4-methoxyphenyl)-4-oxo-4H-chromene-2-carboxylate

SMILES

CCOC(C(Oc1c2ccc(OCc(cc3)ccc3F)c1)=C(c(cc1)ccc1OC)C2=O)=O

InChI

InChI=1S/C26H21FO6/c1-3-31-26(29)25-23(17-6-10-19(30-2)11-7-17)24(28)21-13-12-20(14-22(21)33-25)32-15-16-4-8-18(27)9-5-16/h4-14H,3,15H2,1-2H3

InChI Key

RVRUJBZKFOBRHW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04033866

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.184

Distribution Coefficient, logD

5.184

Water Solubility, LogSw

-5.18

Polar Surface Area

55.803

Acid Dissociation Constant (pKa)

28.94

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with 6737-1398 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6737-1398?
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What is the minimum amount of 6737-1398 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6737-1398
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6737-1398
  • 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 6737-1398 available by request