F195-0199 Screening compound: ethyl 3-{2-[4,6-dimethyl-3-(4-methylbenzenesulfonyl)-2-oxo-1,2-dihydropyridin-1-yl]acetamido}benzoate

F195-0199 Screening compound: ethyl 3-{2-[4,6-dimethyl-3-(4-methylbenzenesulfonyl)-2-oxo-1,2-dihydropyridin-1-yl]acetamido}benzoate
F195-0199 Screening compound: ethyl 3-{2-[4,6-dimethyl-3-(4-methylbenzenesulfonyl)-2-oxo-1,2-dihydropyridin-1-yl]acetamido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound F195-0199
ethyl 3-{2-[4,6-dimethyl-3-(4-methylbenzenesulfonyl)-2-oxo-1,2-dihydropyridin-1-yl]acetamido}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

F195-0199

Molecular Formula

C25H26N2O6S (C25 H26 N2 O6 S)

Compound Name

ethyl 3-{2-[4,6-dimethyl-3-(4-methylbenzenesulfonyl)-2-oxo-1,2-dihydropyridin-1-yl]acetamido}benzoate

IUPAC name

ethyl 3-{2-[46-dimethyl-3-(4-methylbenzenesulfonyl)-2-oxo-12-dihydropyridin-1-yl]acetamido}benzoate

SMILES

CCOC(c1cccc(NC(CN(C(C)=CC(C)=C2S(c3ccc(C)cc3)(=O)=O)C2=O)=O)c1)=O

InChI

InChI=1S/C25H26N2O6S/c1-5-33-25(30)19-7-6-8-20(14-19)26-22(28)15-27-18(4)13-17(3)23(24(27)29)34(31,32)21-11-9-16(2)10-12-21/h6-14H,5,15H2,1-4H3,(H,26,28)

InChI Key

KTPUDZMVXDPIPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD22597421

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.56

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.382

Distribution Coefficient, logD

4.382

Water Solubility, LogSw

-4.24

Polar Surface Area

88.831

Acid Dissociation Constant (pKa)

12.13

Base Dissociation Constant (pKb)

-1.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

F195-0199 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with F195-0199 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F195-0199?
Check Price and Availability of F195-0199, 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 F195-0199 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F195-0199
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F195-0199
  • 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 F195-0199 available by request