F821-0151 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)sulfonyl]piperidine-3-carboxamide

F821-0151 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)sulfonyl]piperidine-3-carboxamide
F821-0151 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)sulfonyl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F821-0151
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)sulfonyl]piperidine-3-carboxamide

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

F821-0151

Molecular Formula

C22H23N3O7S (C22 H23 N3 O7 S)

Compound Name

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)sulfonyl]piperidine-3-carboxamide

IUPAC name

N-(23-dihydro-14-benzodioxin-6-yl)-1-[(3-oxo-34-dihydro-2H-14-benzoxazin-6-yl)sulfonyl]piperidine-3-carboxamide

SMILES

O=C(C(CCC1)CN1S(c(cc1)cc(N2)c1OCC2=O)(=O)=O)Nc(cc1)cc2c1OCCO2

InChI

InChI=1S/C22H23N3O7S/c26-21-13-32-18-6-4-16(11-17(18)24-21)33(28,29)25-7-1-2-14(12-25)22(27)23-15-3-5-19-20(10-15)31-9-8-30-19/h3-6,10-11,14H,1-2,7-9,12-13H2,(H,23,27)(H,24,26)/t14-/m0/s1

InChI Key

YPRVZZICYOEILU-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD14967290

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.51

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.478

Distribution Coefficient, logD

0.477

Water Solubility, LogSw

-2.40

Polar Surface Area

104.067

Acid Dissociation Constant (pKa)

10.15

Base Dissociation Constant (pKb)

2.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

F821-0151 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with F821-0151 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F821-0151?
Check Price and Availability of F821-0151, 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 F821-0151 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F821-0151
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F821-0151
  • 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 F821-0151 available by request