C200-4905 Screening compound: 2-[3-(4-bromobenzoyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide

C200-4905 Screening compound: 2-[3-(4-bromobenzoyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
C200-4905 Screening compound: 2-[3-(4-bromobenzoyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-4905
2-[3-(4-bromobenzoyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide

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

C200-4905

Molecular Formula

C26H26BrN3O3 (C26 H26 BrN3 O3)

Compound Name

2-[3-(4-bromobenzoyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide

IUPAC name

2-[3-(4-bromobenzoyl)-7-methyl-4-oxo-14-dihydro-18-naphthyridin-1-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide

SMILES

Cc(cc1)nc(N(CC(NCCC2=CCCCC2)=O)C=C2C(c(cc3)ccc3Br)=O)c1C2=O

InChI

InChI=1S/C26H26BrN3O3/c1-17-7-12-21-25(33)22(24(32)19-8-10-20(27)11-9-19)15-30(26(21)29-17)16-23(31)28-14-13-18-5-3-2-4-6-18/h5,7-12,15H,2-4,6,13-14,16H2,1H3,(H,28,31)

InChI Key

MFBQLMCQSQPEMW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14727637

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

508.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.029

Distribution Coefficient, logD

5.029

Water Solubility, LogSw

-4.49

Polar Surface Area

63.240

Acid Dissociation Constant (pKa)

15.33

Base Dissociation Constant (pKb)

-0.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

C200-4905 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 C200-4905 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-4905?
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What is the minimum amount of C200-4905 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-4905
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-4905
  • 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 C200-4905 available by request