F601-0535 Screening compound: N~5~-(1,3-benzodioxol-5-yl)-3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxamide

F601-0535 Screening compound: N~5~-(1,3-benzodioxol-5-yl)-3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxamide
F601-0535 Screening compound: N~5~-(1,3-benzodioxol-5-yl)-3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F601-0535
N~5~-(1,3-benzodioxol-5-yl)-3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-5-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

F601-0535

Molecular Formula

C17H14N2O5 (C17 H14 N2 O5)

Compound Name

N~5~-(1,3-benzodioxol-5-yl)-3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxamide

IUPAC name

n/a

SMILES

CCN(c(cc(cc1)C(Nc(cc2)cc3c2OCO3)=O)c1O1)C1=O

InChI

InChI=1S/C17H14N2O5/c1-2-19-12-7-10(3-5-13(12)24-17(19)21)16(20)18-11-4-6-14-15(8-11)23-9-22-14/h3-8H,2,9H2,1H3,(H,18,20)

InChI Key

LFWTYDOAEHRFMJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27178572

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.656

Distribution Coefficient, logD

2.656

Water Solubility, LogSw

-3.15

Polar Surface Area

63.270

Acid Dissociation Constant (pKa)

10.88

Base Dissociation Constant (pKb)

-1.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

F601-0535 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer

References: we are preparing a list of scientific research reports with F601-0535 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F601-0535?
Check Price and Availability of F601-0535, 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 F601-0535 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F601-0535
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F601-0535
  • 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 F601-0535 available by request