3341-3883 Screening compound: 4-(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,5-benzothiazepine

3341-3883 Screening compound: 4-(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,5-benzothiazepine
3341-3883 Screening compound: 4-(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,5-benzothiazepine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3341-3883
4-(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,5-benzothiazepine

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

3341-3883

Molecular Formula

C22H21NO4S (C22 H21 NO4 S)

Compound Name

4-(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,5-benzothiazepine

IUPAC name

4-(furan-2-yl)-2-(345-trimethoxyphenyl)-23-dihydro-15-benzothiazepine

SMILES

COc1cc(C(C2)Sc(cccc3)c3N=C2c2ccco2)cc(OC)c1OC

InChI

InChI=1S/C22H21NO4S/c1-24-18-11-14(12-19(25-2)22(18)26-3)21-13-16(17-8-6-10-27-17)23-15-7-4-5-9-20(15)28-21/h4-12,21H,13H2,1-3H3/t21-/m0/s1

InChI Key

SWGSGCBMMGMDDX-NRFANRHFSA-N

MDL Number (MFCD)

MFCD02165959

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.305

Distribution Coefficient, logD

4.305

Water Solubility, LogSw

-4.36

Polar Surface Area

40.415

Acid Dissociation Constant (pKa)

22.62

Base Dissociation Constant (pKb)

3.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.70

3341-3883 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Nervous system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Ion Channels
  • Kinases

References: we are preparing a list of scientific research reports with 3341-3883 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3341-3883?
Check Price and Availability of 3341-3883, 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 3341-3883 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3341-3883
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3341-3883
  • 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 3341-3883 available by request