F389-0086 Screening compound: (2Z)-6-(4-benzylpiperidine-1-carbonyl)-2-[(4-chlorophenyl)methylidene]-3,4-dihydro-2H-1,4-benzoxazin-3-one

F389-0086 Screening compound: (2Z)-6-(4-benzylpiperidine-1-carbonyl)-2-[(4-chlorophenyl)methylidene]-3,4-dihydro-2H-1,4-benzoxazin-3-one
F389-0086 Screening compound: (2Z)-6-(4-benzylpiperidine-1-carbonyl)-2-[(4-chlorophenyl)methylidene]-3,4-dihydro-2H-1,4-benzoxazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F389-0086
(2Z)-6-(4-benzylpiperidine-1-carbonyl)-2-[(4-chlorophenyl)methylidene]-3,4-dihydro-2H-1,4-benzoxazin-3-one

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

F389-0086

Molecular Formula

C28H25ClN2O3 (C28 H25 ClN2 O3)

Compound Name

(2Z)-6-(4-benzylpiperidine-1-carbonyl)-2-[(4-chlorophenyl)methylidene]-3,4-dihydro-2H-1,4-benzoxazin-3-one

IUPAC name

(2Z)-6-(4-benzylpiperidine-1-carbonyl)-2-[(4-chlorophenyl)methylidene]-34-dihydro-2H-14-benzoxazin-3-one

SMILES

O=C(c(cc1)cc(NC2=O)c1O/C2=C\c(cc1)ccc1Cl)N1CCC(Cc2ccccc2)CC1

InChI

InChI=1S/C28H25ClN2O3/c29-23-9-6-20(7-10-23)17-26-27(32)30-24-18-22(8-11-25(24)34-26)28(33)31-14-12-21(13-15-31)16-19-4-2-1-3-5-19/h1-11,17-18,21H,12-16H2,(H,30,32)

InChI Key

STGOVEHQOPICKA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14952854

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.97

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.909

Distribution Coefficient, logD

5.909

Water Solubility, LogSw

-6.39

Polar Surface Area

49.184

Acid Dissociation Constant (pKa)

12.69

Base Dissociation Constant (pKb)

-1.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

References: we are preparing a list of scientific research reports with F389-0086 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F389-0086?
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What is the minimum amount of F389-0086 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F389-0086
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F389-0086
  • 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 F389-0086 available by request