P158-0317 Screening compound: 3-(azepane-1-sulfonyl)-1-[(4-fluorophenyl)methyl]-1,2-dihydropyridin-2-one

P158-0317 Screening compound: 3-(azepane-1-sulfonyl)-1-[(4-fluorophenyl)methyl]-1,2-dihydropyridin-2-one
P158-0317 Screening compound: 3-(azepane-1-sulfonyl)-1-[(4-fluorophenyl)methyl]-1,2-dihydropyridin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P158-0317
3-(azepane-1-sulfonyl)-1-[(4-fluorophenyl)methyl]-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

P158-0317

Molecular Formula

C18H21FN2O3S (C18 H21 FN2 O3 S)

Compound Name

3-(azepane-1-sulfonyl)-1-[(4-fluorophenyl)methyl]-1,2-dihydropyridin-2-one

IUPAC name

3-(azepane-1-sulfonyl)-1-[(4-fluorophenyl)methyl]-12-dihydropyridin-2-one

SMILES

O=C1N(Cc(cc2)ccc2F)C=CC=C1S(N1CCCCCC1)(=O)=O

InChI

InChI=1S/C18H21FN2O3S/c19-16-9-7-15(8-10-16)14-20-11-5-6-17(18(20)22)25(23,24)21-12-3-1-2-4-13-21/h5-11H,1-4,12-14H2

InChI Key

FGRGHYULWSPDPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27566729

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.375

Distribution Coefficient, logD

2.375

Water Solubility, LogSw

-2.59

Polar Surface Area

47.995

Acid Dissociation Constant (pKa)

27.74

Base Dissociation Constant (pKb)

-4.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

P158-0317 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P158-0317 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P158-0317?
Check Price and Availability of P158-0317, 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 P158-0317 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P158-0317
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P158-0317
  • 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 P158-0317 available by request