C719-0283 Screening compound: 2-(3-{5-chloro-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-oxo-1,6-dihydropyridazin-1-yl}adamantan-1-yl)acetic acid

C719-0283 Screening compound: 2-(3-{5-chloro-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-oxo-1,6-dihydropyridazin-1-yl}adamantan-1-yl)acetic acid
C719-0283 Screening compound: 2-(3-{5-chloro-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-oxo-1,6-dihydropyridazin-1-yl}adamantan-1-yl)acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound C719-0283
2-(3-{5-chloro-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-oxo-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

C719-0283

Molecular Formula

C28H35ClN4O3 (C28 H35 ClN4 O3)

Compound Name

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

IUPAC name

2-(3-{5-chloro-4-[4-(23-dimethylphenyl)piperazin-1-yl]-6-oxo-16-dihydropyridazin-1-yl}adamantan-1-yl)acetic acid

SMILES

Cc1cccc(N(CC2)CCN2C(C=NN(C2(CC(C3)C4)CC4(CC(O)=O)CC3C2)C2=O)=C2Cl)c1C

InChI

InChI=1S/C28H35ClN4O3/c1-18-4-3-5-22(19(18)2)31-6-8-32(9-7-31)23-16-30-33(26(36)25(23)29)28-13-20-10-21(14-28)12-27(11-20,17-28)15-24(34)35/h3-5,16,20-21H,6-15,17H2,1-2H3,(H,34,35)

InChI Key

LYKAQQZEWMOXBA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09696148

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

511.06

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.385

Distribution Coefficient, logD

2.618

Water Solubility, LogSw

-5.62

Polar Surface Area

62.023

Acid Dissociation Constant (pKa)

4.63

Base Dissociation Constant (pKb)

2.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.70

References: we are preparing a list of scientific research reports with C719-0283 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C719-0283?
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What is the minimum amount of C719-0283 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C719-0283
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C719-0283
  • 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 C719-0283 available by request