L068-0138 Screening compound: ethyl 7-[(4-methoxy-3,5-dimethylpyridin-2-yl)methoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate

L068-0138 Screening compound: ethyl 7-[(4-methoxy-3,5-dimethylpyridin-2-yl)methoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate
L068-0138 Screening compound: ethyl 7-[(4-methoxy-3,5-dimethylpyridin-2-yl)methoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound L068-0138
ethyl 7-[(4-methoxy-3,5-dimethylpyridin-2-yl)methoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate

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

L068-0138

Molecular Formula

C24H28N2O5S (C24 H28 N2 O5 S)

Compound Name

ethyl 7-[(4-methoxy-3,5-dimethylpyridin-2-yl)methoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate

IUPAC name

ethyl 7-[(4-methoxy-35-dimethylpyridin-2-yl)methoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate

SMILES

CCC(Nc1c(C(OCC)=O)c2ccc(C)c(OCc3ncc(C)c(OC)c3C)c2s1)=O

InChI

InChI=1S/C24H28N2O5S/c1-7-18(27)26-23-19(24(28)30-8-2)16-10-9-13(3)21(22(16)32-23)31-12-17-15(5)20(29-6)14(4)11-25-17/h9-11H,7-8,12H2,1-6H3,(H,26,27)

InChI Key

IWAJGQVSXSKYQL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15117429

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.988

Distribution Coefficient, logD

4.968

Water Solubility, LogSw

-4.78

Polar Surface Area

69.185

Acid Dissociation Constant (pKa)

8.93

Base Dissociation Constant (pKb)

5.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with L068-0138 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L068-0138?
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What is the minimum amount of L068-0138 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L068-0138
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L068-0138
  • 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 L068-0138 available by request