F389-0497 Screening compound: (2E)-2-[(2-chlorophenyl)methylidene]-N-[2-(cyclohex-1-en-1-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide

F389-0497 Screening compound: (2E)-2-[(2-chlorophenyl)methylidene]-N-[2-(cyclohex-1-en-1-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
F389-0497 Screening compound: (2E)-2-[(2-chlorophenyl)methylidene]-N-[2-(cyclohex-1-en-1-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F389-0497
(2E)-2-[(2-chlorophenyl)methylidene]-N-[2-(cyclohex-1-en-1-yl)ethyl]-3-oxo-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

F389-0497

Molecular Formula

C24H23ClN2O3 (C24 H23 ClN2 O3)

Compound Name

(2E)-2-[(2-chlorophenyl)methylidene]-N-[2-(cyclohex-1-en-1-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide

IUPAC name

(2E)-2-[(2-chlorophenyl)methylidene]-N-[2-(cyclohex-1-en-1-yl)ethyl]-3-oxo-34-dihydro-2H-14-benzoxazine-6-carboxamide

SMILES

O=C(c(cc1)cc(NC2=O)c1O/C2=C/c(cccc1)c1Cl)NCCC1=CCCCC1

InChI

InChI=1S/C24H23ClN2O3/c25-19-9-5-4-8-17(19)15-22-24(29)27-20-14-18(10-11-21(20)30-22)23(28)26-13-12-16-6-2-1-3-7-16/h4-6,8-11,14-15H,1-3,7,12-13H2,(H,26,28)(H,27,29)

InChI Key

MBHHETUJZUPSOI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14953031

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.91

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

4.822

Distribution Coefficient, logD

4.821

Water Solubility, LogSw

-5.12

Polar Surface Area

57.255

Acid Dissociation Constant (pKa)

11.03

Base Dissociation Constant (pKb)

-1.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with F389-0497 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F389-0497?
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What is the minimum amount of F389-0497 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F389-0497
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F389-0497
  • 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 F389-0497 available by request