4488-1630 Screening compound: N-(4-methoxyphenyl)-2-(2-phenoxyacetamido)-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

4488-1630 Screening compound: N-(4-methoxyphenyl)-2-(2-phenoxyacetamido)-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide
4488-1630 Screening compound: N-(4-methoxyphenyl)-2-(2-phenoxyacetamido)-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4488-1630
N-(4-methoxyphenyl)-2-(2-phenoxyacetamido)-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-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

4488-1630

Molecular Formula

C25H26N2O4S (C25 H26 N2 O4 S)

Compound Name

N-(4-methoxyphenyl)-2-(2-phenoxyacetamido)-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

IUPAC name

N-(4-methoxyphenyl)-2-(2-phenoxyacetamido)-4H5H6H7H8H-cyclohepta[b]thiophene-3-carboxamide

SMILES

COc(cc1)ccc1NC(c1c(NC(COc2ccccc2)=O)sc2c1CCCCC2)=O

InChI

InChI=1S/C25H26N2O4S/c1-30-18-14-12-17(13-15-18)26-24(29)23-20-10-6-3-7-11-21(20)32-25(23)27-22(28)16-31-19-8-4-2-5-9-19/h2,4-5,8-9,12-15H,3,6-7,10-11,16H2,1H3,(H,26,29)(H,27,28)

InChI Key

YVSCVSCEEDHUQC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01989120

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.56

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.499

Distribution Coefficient, logD

5.349

Water Solubility, LogSw

-5.41

Polar Surface Area

61.296

Acid Dissociation Constant (pKa)

7.79

Base Dissociation Constant (pKb)

-1.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

4488-1630 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 4488-1630 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4488-1630?
Check Price and Availability of 4488-1630, 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 4488-1630 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4488-1630
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4488-1630
  • 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 4488-1630 available by request