0777-4945 Screening compound: 2-[4-(decyloxy)phenyl] 6-ethyl pyridine-2,6-dicarboxylate

0777-4945 Screening compound: 2-[4-(decyloxy)phenyl] 6-ethyl pyridine-2,6-dicarboxylate
0777-4945 Screening compound: 2-[4-(decyloxy)phenyl] 6-ethyl pyridine-2,6-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0777-4945
2-[4-(decyloxy)phenyl] 6-ethyl pyridine-2,6-dicarboxylate

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

0777-4945

Molecular Formula

C25H33NO5 (C25 H33 NO5)

Compound Name

2-[4-(decyloxy)phenyl] 6-ethyl pyridine-2,6-dicarboxylate

IUPAC name

2-[4-(decyloxy)phenyl] 6-ethyl pyridine-26-dicarboxylate

SMILES

CCCCCCCCCCOc(cc1)ccc1OC(c1nc(C(OCC)=O)ccc1)=O

InChI

InChI=1S/C25H33NO5/c1-3-5-6-7-8-9-10-11-19-30-20-15-17-21(18-16-20)31-25(28)23-14-12-13-22(26-23)24(27)29-4-2/h12-18H,3-11,19H2,1-2H3

InChI Key

FAYQSQMHDXSTHR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00804784

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

7.419

Distribution Coefficient, logD

7.419

Water Solubility, LogSw

-5.75

Polar Surface Area

57.403

Acid Dissociation Constant (pKa)

27.86

Base Dissociation Constant (pKb)

-1.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.00

0777-4945 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 0777-4945 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0777-4945?
Check Price and Availability of 0777-4945, 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 0777-4945 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0777-4945
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0777-4945
  • 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 0777-4945 available by request