F389-0845 Screening compound: (2Z)-3-oxo-N-(2-phenylethyl)-2-(phenylmethylidene)-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide

F389-0845 Screening compound: (2Z)-3-oxo-N-(2-phenylethyl)-2-(phenylmethylidene)-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
F389-0845 Screening compound: (2Z)-3-oxo-N-(2-phenylethyl)-2-(phenylmethylidene)-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F389-0845
(2Z)-3-oxo-N-(2-phenylethyl)-2-(phenylmethylidene)-3,4-dihydro-2H-1,4-benzoxazine-6-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

F389-0845

Molecular Formula

C24H20N2O3 (C24 H20 N2 O3)

Compound Name

(2Z)-3-oxo-N-(2-phenylethyl)-2-(phenylmethylidene)-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide

IUPAC name

(2Z)-3-oxo-N-(2-phenylethyl)-2-(phenylmethylidene)-34-dihydro-2H-14-benzoxazine-6-carboxamide

SMILES

O=C(c(cc1)cc(NC2=O)c1O/C2=C\c1ccccc1)NCCc1ccccc1

InChI

InChI=1S/C24H20N2O3/c27-23(25-14-13-17-7-3-1-4-8-17)19-11-12-21-20(16-19)26-24(28)22(29-21)15-18-9-5-2-6-10-18/h1-12,15-16H,13-14H2,(H,25,27)(H,26,28)

InChI Key

IBKWRWRQAHGMDU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14953192

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.950

Distribution Coefficient, logD

3.950

Water Solubility, LogSw

-4.28

Polar Surface Area

57.062

Acid Dissociation Constant (pKa)

11.97

Base Dissociation Constant (pKb)

-2.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

References: we are preparing a list of scientific research reports with F389-0845 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F389-0845?
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What is the minimum amount of F389-0845 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F389-0845
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F389-0845
  • 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 F389-0845 available by request