P733-0300 Screening compound: (2-fluorophenyl)methyl 2-ethoxy-4-oxo-4H,6H,7H,8H,9H,10H-pyrido[1,2-a]azepine-1-carboxylate

P733-0300 Screening compound: (2-fluorophenyl)methyl 2-ethoxy-4-oxo-4H,6H,7H,8H,9H,10H-pyrido[1,2-a]azepine-1-carboxylate
P733-0300 Screening compound: (2-fluorophenyl)methyl 2-ethoxy-4-oxo-4H,6H,7H,8H,9H,10H-pyrido[1,2-a]azepine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound P733-0300
(2-fluorophenyl)methyl 2-ethoxy-4-oxo-4H,6H,7H,8H,9H,10H-pyrido[1,2-a]azepine-1-carboxylate

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

P733-0300

Molecular Formula

C20H22FNO4 (C20 H22 FNO4)

Compound Name

(2-fluorophenyl)methyl 2-ethoxy-4-oxo-4H,6H,7H,8H,9H,10H-pyrido[1,2-a]azepine-1-carboxylate

IUPAC name

(2-fluorophenyl)methyl 2-ethoxy-4-oxo-4H6H7H8H9H10H-pyrido[12-a]azepine-1-carboxylate

SMILES

CCOC(C(C(OCc(cccc1)c1F)=O)=C1N2CCCCC1)=CC2=O

InChI

InChI=1S/C20H22FNO4/c1-2-25-17-12-18(23)22-11-7-3-4-10-16(22)19(17)20(24)26-13-14-8-5-6-9-15(14)21/h5-6,8-9,12H,2-4,7,10-11,13H2,1H3

InChI Key

QHRTXGYTBWZWSI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27614134

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.463

Distribution Coefficient, logD

3.463

Water Solubility, LogSw

-3.48

Polar Surface Area

45.003

Acid Dissociation Constant (pKa)

27.72

Base Dissociation Constant (pKb)

-2.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

P733-0300 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Anti-HIV1 Library (19540 compounds)

Antibacterial Compounds Library (13827 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with P733-0300 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P733-0300?
Check Price and Availability of P733-0300, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of P733-0300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P733-0300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P733-0300
  • 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 P733-0300 available by request