Z606-0537 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-3,4-dihydro-2H-1,4-benzoxazine-4-carboxamide

Z606-0537 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-3,4-dihydro-2H-1,4-benzoxazine-4-carboxamide
Z606-0537 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-3,4-dihydro-2H-1,4-benzoxazine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Z606-0537
N-(2H-1,3-benzodioxol-5-yl)-3,4-dihydro-2H-1,4-benzoxazine-4-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

Z606-0537

Molecular Formula

C16H14N2O4 (C16 H14 N2 O4)

Compound Name

N-(2H-1,3-benzodioxol-5-yl)-3,4-dihydro-2H-1,4-benzoxazine-4-carboxamide

IUPAC name

N-(2H-13-benzodioxol-5-yl)-34-dihydro-2H-14-benzoxazine-4-carboxamide

SMILES

O=C(Nc(cc1)cc2c1OCO2)N1c(cccc2)c2OCC1

InChI

InChI=1S/C16H14N2O4/c19-16(17-11-5-6-14-15(9-11)22-10-21-14)18-7-8-20-13-4-2-1-3-12(13)18/h1-6,9H,7-8,10H2,(H,17,19)

InChI Key

YWFPUNRNJFALEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27640445

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.008

Distribution Coefficient, logD

3.008

Water Solubility, LogSw

-3.35

Polar Surface Area

49.439

Acid Dissociation Constant (pKa)

13.14

Base Dissociation Constant (pKb)

2.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

Z606-0537 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

CNS Targets (44014 compounds)

Fragments Library (11262 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
  • PPI modulators
Structure:
  • Fragments
  • Cyclic compounds
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with Z606-0537 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Z606-0537?
Check Price and Availability of Z606-0537, 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 Z606-0537 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Z606-0537
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Z606-0537
  • 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 Z606-0537 available by request