K783-4391 Screening compound: ethyl 2-(2-ethyl-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)acetate

K783-4391 Screening compound: ethyl 2-(2-ethyl-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)acetate
K783-4391 Screening compound: ethyl 2-(2-ethyl-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound K783-4391
ethyl 2-(2-ethyl-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)acetate

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

K783-4391

Molecular Formula

C15H19NO4 (C15 H19 NO4)

Compound Name

ethyl 2-(2-ethyl-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)acetate

IUPAC name

ethyl 2-(2-ethyl-6-methyl-3-oxo-34-dihydro-2H-14-benzoxazin-4-yl)acetate

SMILES

CCC1Oc(ccc(C)c2)c2N(CC(OCC)=O)C1=O

InChI

InChI=1S/C15H19NO4/c1-4-12-15(18)16(9-14(17)19-5-2)11-8-10(3)6-7-13(11)20-12/h6-8,12H,4-5,9H2,1-3H3/t12-/m0/s1

InChI Key

PMIVSPZOFQDLQC-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD03450634

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

277.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.750

Distribution Coefficient, logD

2.750

Water Solubility, LogSw

-2.91

Polar Surface Area

43.697

Acid Dissociation Constant (pKa)

18.50

Base Dissociation Constant (pKb)

-4.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.70

K783-4391 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K783-4391 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K783-4391?
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What is the minimum amount of K783-4391 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K783-4391
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K783-4391
  • 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 K783-4391 available by request