C850-0151 Screening compound: 1-[5-chloro-4-(3,5-dimethylpiperidin-1-yl)-6-oxo-1,6-dihydropyridazin-1-yl]adamantane-2-carboxylic acid

C850-0151 Screening compound: 1-[5-chloro-4-(3,5-dimethylpiperidin-1-yl)-6-oxo-1,6-dihydropyridazin-1-yl]adamantane-2-carboxylic acid
C850-0151 Screening compound: 1-[5-chloro-4-(3,5-dimethylpiperidin-1-yl)-6-oxo-1,6-dihydropyridazin-1-yl]adamantane-2-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound C850-0151
1-[5-chloro-4-(3,5-dimethylpiperidin-1-yl)-6-oxo-1,6-dihydropyridazin-1-yl]adamantane-2-carboxylic 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

C850-0151

Molecular Formula

C22H30ClN3O3 (C22 H30 ClN3 O3)

Compound Name

1-[5-chloro-4-(3,5-dimethylpiperidin-1-yl)-6-oxo-1,6-dihydropyridazin-1-yl]adamantane-2-carboxylic acid

IUPAC name

1-[5-chloro-4-(35-dimethylpiperidin-1-yl)-6-oxo-16-dihydropyridazin-1-yl]adamantane-2-carboxylic acid

SMILES

CC(CC(C)C1)CN1C(C=NN(C1(CC(C2)CC3CC2C1)C3C(O)=O)C1=O)=C1Cl

InChI

InChI=1S/C22H30ClN3O3/c1-12-3-13(2)11-25(10-12)17-9-24-26(20(27)19(17)23)22-7-14-4-15(8-22)6-16(5-14)18(22)21(28)29/h9,12-16,18H,3-8,10-11H2,1-2H3,(H,28,29)

InChI Key

ODYMWIZYAYYCJO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09696085

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.95

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.842

Distribution Coefficient, logD

1.506

Water Solubility, LogSw

-3.98

Polar Surface Area

58.420

Acid Dissociation Constant (pKa)

5.07

Base Dissociation Constant (pKb)

3.04

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

77.30

C850-0151 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C850-0151 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C850-0151?
Check Price and Availability of C850-0151, 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 C850-0151 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C850-0151
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C850-0151
  • 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 C850-0151 available by request