C719-0277 Screening compound: 2-[3-(5-chloro-6-oxo-4-{[(oxolan-2-yl)methyl]amino}-1,6-dihydropyridazin-1-yl)adamantan-1-yl]acetic acid

C719-0277 Screening compound: 2-[3-(5-chloro-6-oxo-4-{[(oxolan-2-yl)methyl]amino}-1,6-dihydropyridazin-1-yl)adamantan-1-yl]acetic acid
C719-0277 Screening compound: 2-[3-(5-chloro-6-oxo-4-{[(oxolan-2-yl)methyl]amino}-1,6-dihydropyridazin-1-yl)adamantan-1-yl]acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound C719-0277
2-[3-(5-chloro-6-oxo-4-{[(oxolan-2-yl)methyl]amino}-1,6-dihydropyridazin-1-yl)adamantan-1-yl]acetic acid

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

C719-0277

Molecular Formula

C21H28ClN3O4 (C21 H28 ClN3 O4)

Compound Name

2-[3-(5-chloro-6-oxo-4-{[(oxolan-2-yl)methyl]amino}-1,6-dihydropyridazin-1-yl)adamantan-1-yl]acetic acid

IUPAC name

2-[3-(5-chloro-6-oxo-4-{[(oxolan-2-yl)methyl]amino}-16-dihydropyridazin-1-yl)adamantan-1-yl]acetic acid

SMILES

OC(CC(CC(C1)C2)(CC1C1)CC12N(C1=O)N=CC(NCC2OCCC2)=C1Cl)=O

InChI

InChI=1S/C21H28ClN3O4/c22-18-16(23-10-15-2-1-3-29-15)11-24-25(19(18)28)21-7-13-4-14(8-21)6-20(5-13,12-21)9-17(26)27/h11,13-15,23H,1-10,12H2,(H,26,27)

InChI Key

DVBMTEUIDSJCBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06610242

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.92

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

2.405

Distribution Coefficient, logD

-0.362

Water Solubility, LogSw

-3.10

Polar Surface Area

73.856

Acid Dissociation Constant (pKa)

4.63

Base Dissociation Constant (pKb)

2.68

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

76.20

C719-0277 in Drug Discovery

Included in Screening Libraries

Nucleoside Mimetics Library (2197 compounds)

Regenerative Medicine Focused Library (23016 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Cancer
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Structure:
  • Mimetics
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C719-0277 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C719-0277?
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What is the minimum amount of C719-0277 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C719-0277
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C719-0277
  • 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 C719-0277 available by request