8755-0380 Screening compound: 2-benzamido-N-[5-(diethylamino)pentan-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

8755-0380 Screening compound: 2-benzamido-N-[5-(diethylamino)pentan-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
8755-0380 Screening compound: 2-benzamido-N-[5-(diethylamino)pentan-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8755-0380
2-benzamido-N-[5-(diethylamino)pentan-2-yl]-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

8755-0380

Molecular Formula

C25H35N3O2S (C25 H35 N3 O2 S)

Compound Name

2-benzamido-N-[5-(diethylamino)pentan-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

IUPAC name

2-benzamido-N-[5-(diethylamino)pentan-2-yl]-4567-tetrahydro-1-benzothiophene-3-carboxamide

SMILES

CCN(CC)CCCC(C)NC(c1c(NC(c2ccccc2)=O)sc2c1CCCC2)=O

InChI

InChI=1S/C25H35N3O2S/c1-4-28(5-2)17-11-12-18(3)26-24(30)22-20-15-9-10-16-21(20)31-25(22)27-23(29)19-13-7-6-8-14-19/h6-8,13-14,18H,4-5,9-12,15-17H2,1-3H3,(H,26,30)(H,27,29)/t18-/m0/s1

InChI Key

UJDINNKEDFGRQP-SFHVURJKSA-N

MDL Number (MFCD)

MFCD00731211

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.64

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.287

Distribution Coefficient, logD

4.287

Water Solubility, LogSw

-4.17

Polar Surface Area

50.582

Acid Dissociation Constant (pKa)

5.30

Base Dissociation Constant (pKb)

10.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.00

8755-0380 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 8755-0380 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8755-0380?
Check Price and Availability of 8755-0380, 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 8755-0380 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8755-0380
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8755-0380
  • 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 8755-0380 available by request