C200-4263 Screening compound: {[3-(methylsulfanyl)phenyl]carbamoyl}methyl 1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate

C200-4263 Screening compound: {[3-(methylsulfanyl)phenyl]carbamoyl}methyl 1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate
C200-4263 Screening compound: {[3-(methylsulfanyl)phenyl]carbamoyl}methyl 1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-4263
{[3-(methylsulfanyl)phenyl]carbamoyl}methyl 1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-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

C200-4263

Molecular Formula

C21H21N3O4S (C21 H21 N3 O4 S)

Compound Name

{[3-(methylsulfanyl)phenyl]carbamoyl}methyl 1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate

IUPAC name

{[3-(methylsulfanyl)phenyl]carbamoyl}methyl 1-ethyl-7-methyl-4-oxo-14-dihydro-18-naphthyridine-3-carboxylate

SMILES

CCN(C=C1C(OCC(Nc2cccc(SC)c2)=O)=O)c(nc(C)cc2)c2C1=O

InChI

InChI=1S/C21H21N3O4S/c1-4-24-11-17(19(26)16-9-8-13(2)22-20(16)24)21(27)28-12-18(25)23-14-6-5-7-15(10-14)29-3/h5-11H,4,12H2,1-3H3,(H,23,25)

InChI Key

SJOUUWVZDWXALE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14727295

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.501

Distribution Coefficient, logD

3.501

Water Solubility, LogSw

-3.72

Polar Surface Area

69.271

Acid Dissociation Constant (pKa)

12.93

Base Dissociation Constant (pKb)

-1.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

C200-4263 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C200-4263 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-4263?
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What is the minimum amount of C200-4263 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-4263
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-4263
  • 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 C200-4263 available by request