F325-1698 Screening compound: 1-[4-(azepan-1-yl)-4-oxobutanoyl]-N-(2-methoxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide

F325-1698 Screening compound: 1-[4-(azepan-1-yl)-4-oxobutanoyl]-N-(2-methoxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide
F325-1698 Screening compound: 1-[4-(azepan-1-yl)-4-oxobutanoyl]-N-(2-methoxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F325-1698
1-[4-(azepan-1-yl)-4-oxobutanoyl]-N-(2-methoxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide

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

F325-1698

Molecular Formula

C21H31N3O5S (C21 H31 N3 O5 S)

Compound Name

1-[4-(azepan-1-yl)-4-oxobutanoyl]-N-(2-methoxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide

IUPAC name

1-[4-(azepan-1-yl)-4-oxobutanoyl]-N-(2-methoxyethyl)-23-dihydro-1H-indole-5-sulfonamide

SMILES

COCCNS(c(cc1)cc(CC2)c1N2C(CCC(N1CCCCCC1)=O)=O)(=O)=O

InChI

InChI=1S/C21H31N3O5S/c1-29-15-11-22-30(27,28)18-6-7-19-17(16-18)10-14-24(19)21(26)9-8-20(25)23-12-4-2-3-5-13-23/h6-7,16,22H,2-5,8-15H2,1H3

InChI Key

WKYHLBNOOPMIEE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27116835

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.56

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.651

Distribution Coefficient, logD

1.651

Water Solubility, LogSw

-2.62

Polar Surface Area

82.327

Acid Dissociation Constant (pKa)

11.30

Base Dissociation Constant (pKb)

6.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.90

F325-1698 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F325-1698 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F325-1698?
Check Price and Availability of F325-1698, 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 F325-1698 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F325-1698
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F325-1698
  • 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 F325-1698 available by request