C719-0337 Screening compound: 2-(3-{5-chloro-4-[(2,5-diethoxyphenyl)amino]-6-oxo-1,6-dihydropyridazin-1-yl}adamantan-1-yl)acetic acid

C719-0337 Screening compound: 2-(3-{5-chloro-4-[(2,5-diethoxyphenyl)amino]-6-oxo-1,6-dihydropyridazin-1-yl}adamantan-1-yl)acetic acid
C719-0337 Screening compound: 2-(3-{5-chloro-4-[(2,5-diethoxyphenyl)amino]-6-oxo-1,6-dihydropyridazin-1-yl}adamantan-1-yl)acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound C719-0337
2-(3-{5-chloro-4-[(2,5-diethoxyphenyl)amino]-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

C719-0337

Molecular Formula

C26H32ClN3O5 (C26 H32 ClN3 O5)

Compound Name

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

IUPAC name

2-(3-{5-chloro-4-[(25-diethoxyphenyl)amino]-6-oxo-16-dihydropyridazin-1-yl}adamantan-1-yl)acetic acid

SMILES

CCOc(cc1)cc(NC(C=NN(C2(CC(C3)C4)CC4(CC(O)=O)CC3C2)C2=O)=C2Cl)c1OCC

InChI

InChI=1S/C26H32ClN3O5/c1-3-34-18-5-6-21(35-4-2)19(8-18)29-20-14-28-30(24(33)23(20)27)26-11-16-7-17(12-26)10-25(9-16,15-26)13-22(31)32/h5-6,8,14,16-17,29H,3-4,7,9-13,15H2,1-2H3,(H,31,32)

InChI Key

DQYZHJGXLBRMCO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09696132

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

502.01

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.836

Distribution Coefficient, logD

2.069

Water Solubility, LogSw

-4.57

Polar Surface Area

77.516

Acid Dissociation Constant (pKa)

4.63

Base Dissociation Constant (pKb)

4.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.70

References: we are preparing a list of scientific research reports with C719-0337 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C719-0337?
Check Price and Availability of C719-0337, 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 C719-0337 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C719-0337
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C719-0337
  • 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 C719-0337 available by request