P511-0462 Screening compound: 5-(azepane-1-sulfonyl)-1-[(3,5-difluorophenyl)methyl]-1,2-dihydropyridin-2-one

P511-0462 Screening compound: 5-(azepane-1-sulfonyl)-1-[(3,5-difluorophenyl)methyl]-1,2-dihydropyridin-2-one
P511-0462 Screening compound: 5-(azepane-1-sulfonyl)-1-[(3,5-difluorophenyl)methyl]-1,2-dihydropyridin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P511-0462
5-(azepane-1-sulfonyl)-1-[(3,5-difluorophenyl)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

P511-0462

Molecular Formula

C18H20F2N2O3S (C18 H20 F2 N2 O3 S)

Compound Name

5-(azepane-1-sulfonyl)-1-[(3,5-difluorophenyl)methyl]-1,2-dihydropyridin-2-one

IUPAC name

5-(azepane-1-sulfonyl)-1-[(35-difluorophenyl)methyl]-12-dihydropyridin-2-one

SMILES

O=C(C=C1)N(Cc2cc(F)cc(F)c2)C=C1S(N1CCCCCC1)(=O)=O

InChI

InChI=1S/C18H20F2N2O3S/c19-15-9-14(10-16(20)11-15)12-21-13-17(5-6-18(21)23)26(24,25)22-7-3-1-2-4-8-22/h5-6,9-11,13H,1-4,7-8,12H2

InChI Key

PDYDMFSUXKPMDP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27577963

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.43

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

2.584

Distribution Coefficient, logD

2.584

Water Solubility, LogSw

-2.71

Polar Surface Area

48.791

Acid Dissociation Constant (pKa)

27.74

Base Dissociation Constant (pKb)

-4.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

P511-0462 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with P511-0462 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P511-0462?
Check Price and Availability of P511-0462, 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 P511-0462 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P511-0462
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P511-0462
  • 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 P511-0462 available by request