4798-0021 Screening compound: 4-chloro-3-[(2-hydroxyphenyl)amino]-5-oxo-2,5-dihydrofuran-2-yl 4-methylbenzoate

4798-0021 Screening compound: 4-chloro-3-[(2-hydroxyphenyl)amino]-5-oxo-2,5-dihydrofuran-2-yl 4-methylbenzoate
4798-0021 Screening compound: 4-chloro-3-[(2-hydroxyphenyl)amino]-5-oxo-2,5-dihydrofuran-2-yl 4-methylbenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4798-0021
4-chloro-3-[(2-hydroxyphenyl)amino]-5-oxo-2,5-dihydrofuran-2-yl 4-methylbenzoate

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

4798-0021

Molecular Formula

C18H14ClNO5 (C18 H14 ClNO5)

Compound Name

4-chloro-3-[(2-hydroxyphenyl)amino]-5-oxo-2,5-dihydrofuran-2-yl 4-methylbenzoate

IUPAC name

4-chloro-3-[(2-hydroxyphenyl)amino]-5-oxo-25-dihydrofuran-2-yl 4-methylbenzoate

SMILES

Cc(cc1)ccc1C(OC(C(Nc(cccc1)c1O)=C1Cl)OC1=O)=O

InChI

InChI=1S/C18H14ClNO5/c1-10-6-8-11(9-7-10)16(22)24-18-15(14(19)17(23)25-18)20-12-4-2-3-5-13(12)21/h2-9,18,20-21H,1H3/t18-/m1/s1

InChI Key

HNUAMHMNCOXKAO-GOSISDBHSA-N

MDL Number (MFCD)

MFCD02320221

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.77

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.168

Distribution Coefficient, logD

3.962

Water Solubility, LogSw

-4.02

Polar Surface Area

68.487

Acid Dissociation Constant (pKa)

7.62

Base Dissociation Constant (pKb)

2.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with 4798-0021 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4798-0021?
Check Price and Availability of 4798-0021, 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 4798-0021 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4798-0021
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4798-0021
  • 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 4798-0021 available by request