3245-0151 Screening compound: 4-chloro-3-[(3,4-dimethylphenyl)amino]-5-oxo-2,5-dihydrofuran-2-yl benzoate

3245-0151 Screening compound: 4-chloro-3-[(3,4-dimethylphenyl)amino]-5-oxo-2,5-dihydrofuran-2-yl benzoate
3245-0151 Screening compound: 4-chloro-3-[(3,4-dimethylphenyl)amino]-5-oxo-2,5-dihydrofuran-2-yl benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3245-0151
4-chloro-3-[(3,4-dimethylphenyl)amino]-5-oxo-2,5-dihydrofuran-2-yl benzoate

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

3245-0151

Molecular Formula

C19H16ClNO4 (C19 H16 ClNO4)

Compound Name

4-chloro-3-[(3,4-dimethylphenyl)amino]-5-oxo-2,5-dihydrofuran-2-yl benzoate

IUPAC name

4-chloro-3-[(34-dimethylphenyl)amino]-5-oxo-25-dihydrofuran-2-yl benzoate

SMILES

Cc(cc1)c(C)cc1NC(C(OC(c1ccccc1)=O)OC1=O)=C1Cl

InChI

InChI=1S/C19H16ClNO4/c1-11-8-9-14(10-12(11)2)21-16-15(20)18(23)25-19(16)24-17(22)13-6-4-3-5-7-13/h3-10,19,21H,1-2H3/t19-/m1/s1

InChI Key

AYDBXYVOEGAAHT-LJQANCHMSA-N

MDL Number (MFCD)

MFCD03015671

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.79

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.836

Distribution Coefficient, logD

4.808

Water Solubility, LogSw

-4.90

Polar Surface Area

52.636

Acid Dissociation Constant (pKa)

8.58

Base Dissociation Constant (pKb)

3.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with 3245-0151 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3245-0151?
Check Price and Availability of 3245-0151, 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 3245-0151 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3245-0151
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3245-0151
  • 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 3245-0151 available by request