1488-0302 Screening compound: 2-(4-butoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

1488-0302 Screening compound: 2-(4-butoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
1488-0302 Screening compound: 2-(4-butoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1488-0302
2-(4-butoxybenzamido)-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

1488-0302

Molecular Formula

C20H24N2O3S (C20 H24 N2 O3 S)

Compound Name

2-(4-butoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

IUPAC name

2-(4-butoxybenzamido)-4567-tetrahydro-1-benzothiophene-3-carboxamide

SMILES

CCCCOc(cc1)ccc1C(Nc1c(C(N)=O)c(CCCC2)c2s1)=O

InChI

InChI=1S/C20H24N2O3S/c1-2-3-12-25-14-10-8-13(9-11-14)19(24)22-20-17(18(21)23)15-6-4-5-7-16(15)26-20/h8-11H,2-7,12H2,1H3,(H2,21,23)(H,22,24)

InChI Key

KHCXJRIOUPJGCS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01536889

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.427

Distribution Coefficient, logD

2.143

Water Solubility, LogSw

-3.90

Polar Surface Area

64.521

Acid Dissociation Constant (pKa)

6.14

Base Dissociation Constant (pKb)

-2.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

1488-0302 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1488-0302 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1488-0302?
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What is the minimum amount of 1488-0302 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1488-0302
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1488-0302
  • 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 1488-0302 available by request