P158-0060 Screening compound: 1-[(3-fluoro-4-methoxyphenyl)methyl]-3-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-2-one

P158-0060 Screening compound: 1-[(3-fluoro-4-methoxyphenyl)methyl]-3-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-2-one
P158-0060 Screening compound: 1-[(3-fluoro-4-methoxyphenyl)methyl]-3-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P158-0060
1-[(3-fluoro-4-methoxyphenyl)methyl]-3-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-2-one

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

P158-0060

Molecular Formula

C17H19FN2O4S (C17 H19 FN2 O4 S)

Compound Name

1-[(3-fluoro-4-methoxyphenyl)methyl]-3-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-2-one

IUPAC name

1-[(3-fluoro-4-methoxyphenyl)methyl]-3-(pyrrolidine-1-sulfonyl)-12-dihydropyridin-2-one

SMILES

COc(ccc(CN(C=CC=C1S(N2CCCC2)(=O)=O)C1=O)c1)c1F

InChI

InChI=1S/C17H19FN2O4S/c1-24-15-7-6-13(11-14(15)18)12-19-8-4-5-16(17(19)21)25(22,23)20-9-2-3-10-20/h4-8,11H,2-3,9-10,12H2,1H3

InChI Key

BOFRWSHQFCAFKQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27566708

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.479

Distribution Coefficient, logD

1.479

Water Solubility, LogSw

-2.46

Polar Surface Area

55.660

Acid Dissociation Constant (pKa)

27.94

Base Dissociation Constant (pKb)

-4.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

P158-0060 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with P158-0060 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P158-0060?
Check Price and Availability of P158-0060, 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 P158-0060 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P158-0060
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P158-0060
  • 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 P158-0060 available by request