P682-1299 Screening compound: 4-hydroxy-1-(3-methoxyphenyl)-2-oxo-N-[(thiophen-2-yl)methyl]-1,2-dihydro-1,8-naphthyridine-3-carboxamide

P682-1299 Screening compound: 4-hydroxy-1-(3-methoxyphenyl)-2-oxo-N-[(thiophen-2-yl)methyl]-1,2-dihydro-1,8-naphthyridine-3-carboxamide
P682-1299 Screening compound: 4-hydroxy-1-(3-methoxyphenyl)-2-oxo-N-[(thiophen-2-yl)methyl]-1,2-dihydro-1,8-naphthyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P682-1299
4-hydroxy-1-(3-methoxyphenyl)-2-oxo-N-[(thiophen-2-yl)methyl]-1,2-dihydro-1,8-naphthyridine-3-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

P682-1299

Molecular Formula

C21H17N3O4S (C21 H17 N3 O4 S)

Compound Name

4-hydroxy-1-(3-methoxyphenyl)-2-oxo-N-[(thiophen-2-yl)methyl]-1,2-dihydro-1,8-naphthyridine-3-carboxamide

IUPAC name

4-hydroxy-1-(3-methoxyphenyl)-2-oxo-N-[(thiophen-2-yl)methyl]-12-dihydro-18-naphthyridine-3-carboxamide

SMILES

COc1cccc(N(c(nccc2)c2C(O)=C2C(NCc3cccs3)=O)C2=O)c1

InChI

InChI=1S/C21H17N3O4S/c1-28-14-6-2-5-13(11-14)24-19-16(8-3-9-22-19)18(25)17(21(24)27)20(26)23-12-15-7-4-10-29-15/h2-11,25H,12H2,1H3,(H,23,26)

InChI Key

AMIUADFXLYQLRA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27611934

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.457

Distribution Coefficient, logD

-0.491

Water Solubility, LogSw

-2.88

Polar Surface Area

73.107

Acid Dissociation Constant (pKa)

4.45

Base Dissociation Constant (pKb)

-3.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

P682-1299 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Hsp90-Targeted Library (11355 compounds)

SmartTM Library (51161 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • Proteases
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P682-1299 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P682-1299?
Check Price and Availability of P682-1299, 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 P682-1299 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P682-1299
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P682-1299
  • 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 P682-1299 available by request