F780-6523 Screening compound: N-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-2-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)acetamide

F780-6523 Screening compound: N-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-2-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)acetamide
F780-6523 Screening compound: N-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-2-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F780-6523
N-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-2-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)acetamide

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

F780-6523

Molecular Formula

C25H21ClN4O3 (C25 H21 ClN4 O3)

Compound Name

N-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-2-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)acetamide

IUPAC name

N-{2-[2-(1H-13-benzodiazol-2-yl)ethyl]phenyl}-2-(6-chloro-3-oxo-34-dihydro-2H-14-benzoxazin-4-yl)acetamide

SMILES

O=C(CN1c(cc(cc2)Cl)c2OCC1=O)Nc1c(CCc2nc(cccc3)c3[nH]2)cccc1

InChI

InChI=1S/C25H21ClN4O3/c26-17-10-11-22-21(13-17)30(25(32)15-33-22)14-24(31)29-18-6-2-1-5-16(18)9-12-23-27-19-7-3-4-8-20(19)28-23/h1-8,10-11,13H,9,12,14-15H2,(H,27,28)(H,29,31)

InChI Key

JTHOWYJYTTYZGN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27189720

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.92

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.392

Distribution Coefficient, logD

4.332

Water Solubility, LogSw

-4.60

Polar Surface Area

66.530

Acid Dissociation Constant (pKa)

11.93

Base Dissociation Constant (pKb)

6.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

F780-6523 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system

References: we are preparing a list of scientific research reports with F780-6523 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F780-6523?
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What is the minimum amount of F780-6523 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F780-6523
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F780-6523
  • 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 F780-6523 available by request