0703-6482 Screening compound: 2-(4-{4-[6-(ethoxycarbonyl)pyridine-2-carbonyloxy]benzenesulfonyl}phenyl) 6-ethyl pyridine-2,6-dicarboxylate

0703-6482 Screening compound: 2-(4-{4-[6-(ethoxycarbonyl)pyridine-2-carbonyloxy]benzenesulfonyl}phenyl) 6-ethyl pyridine-2,6-dicarboxylate
0703-6482 Screening compound: 2-(4-{4-[6-(ethoxycarbonyl)pyridine-2-carbonyloxy]benzenesulfonyl}phenyl) 6-ethyl pyridine-2,6-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0703-6482
2-(4-{4-[6-(ethoxycarbonyl)pyridine-2-carbonyloxy]benzenesulfonyl}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

0703-6482

Molecular Formula

C30H24N2O10S (C30 H24 N2 O10 S)

Compound Name

2-(4-{4-[6-(ethoxycarbonyl)pyridine-2-carbonyloxy]benzenesulfonyl}phenyl) 6-ethyl pyridine-2,6-dicarboxylate

IUPAC name

2-(4-{4-[6-(ethoxycarbonyl)pyridine-2-carbonyloxy]benzenesulfonyl}phenyl) 6-ethyl pyridine-26-dicarboxylate

SMILES

CCOC(c1cccc(C(Oc(cc2)ccc2S(c(cc2)ccc2OC(c2nc(C(OCC)=O)ccc2)=O)(=O)=O)=O)n1)=O

InChI

InChI=1S/C30H24N2O10S/c1-3-39-27(33)23-7-5-9-25(31-23)29(35)41-19-11-15-21(16-12-19)43(37,38)22-17-13-20(14-18-22)42-30(36)26-10-6-8-24(32-26)28(34)40-4-2/h5-18H,3-4H2,1-2H3

InChI Key

AIVVSMISLJKMGD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01535892

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

604.59

Hydrogen Bond Acceptors Count

18.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

4.721

Distribution Coefficient, logD

4.721

Water Solubility, LogSw

-4.50

Polar Surface Area

129.234

Acid Dissociation Constant (pKa)

30.24

Base Dissociation Constant (pKb)

-1.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

0703-6482 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0703-6482 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0703-6482?
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What is the minimum amount of 0703-6482 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0703-6482
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0703-6482
  • 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 0703-6482 available by request