2389-2494 Screening compound: 2-[2-(2-methoxyphenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

2389-2494 Screening compound: 2-[2-(2-methoxyphenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2389-2494 Screening compound: 2-[2-(2-methoxyphenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2389-2494
2-[2-(2-methoxyphenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

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

2389-2494

Molecular Formula

C18H20N2O4S (C18 H20 N2 O4 S)

Compound Name

2-[2-(2-methoxyphenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

IUPAC name

2-[2-(2-methoxyphenoxy)acetamido]-4567-tetrahydro-1-benzothiophene-3-carboxamide

SMILES

COc(cccc1)c1OCC(Nc1c(C(N)=O)c(CCCC2)c2s1)=O

InChI

InChI=1S/C18H20N2O4S/c1-23-12-7-3-4-8-13(12)24-10-15(21)20-18-16(17(19)22)11-6-2-5-9-14(11)25-18/h3-4,7-8H,2,5-6,9-10H2,1H3,(H2,19,22)(H,20,21)

InChI Key

VPMDQOULYWSNGQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01847470

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.749

Distribution Coefficient, logD

1.390

Water Solubility, LogSw

-2.30

Polar Surface Area

72.106

Acid Dissociation Constant (pKa)

7.29

Base Dissociation Constant (pKb)

-2.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

2389-2494 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 2389-2494 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2389-2494?
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What is the minimum amount of 2389-2494 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2389-2494
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2389-2494
  • 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 2389-2494 available by request