3461-1688 Screening compound: 4-chloro-N~1~-(9-methyl-7,8,9,10-tetrahydronaphtho[1,2-b][1]benzofuran-5-yl)-1-benzenesulfonamide

3461-1688 Screening compound: 4-chloro-N~1~-(9-methyl-7,8,9,10-tetrahydronaphtho[1,2-b][1]benzofuran-5-yl)-1-benzenesulfonamide
3461-1688 Screening compound: 4-chloro-N~1~-(9-methyl-7,8,9,10-tetrahydronaphtho[1,2-b][1]benzofuran-5-yl)-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3461-1688
4-chloro-N~1~-(9-methyl-7,8,9,10-tetrahydronaphtho[1,2-b][1]benzofuran-5-yl)-1-benzenesulfonamide

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

3461-1688

Molecular Formula

C23H20ClNO3S (C23 H20 ClNO3 S)

Compound Name

4-chloro-N~1~-(9-methyl-7,8,9,10-tetrahydronaphtho[1,2-b][1]benzofuran-5-yl)-1-benzenesulfonamide

IUPAC name

4-chloro-N-{14-methyl-17-oxatetracyclo[8.7.0.0^{27}.0^{1116}]heptadeca-1(10)2(7)35811(16)-hexaen-8-yl}benzene-1-sulfonamide

SMILES

CC(CC1)Cc2c1c(cc(c1ccccc11)NS(c(cc3)ccc3Cl)(=O)=O)c1o2

InChI

InChI=1S/C23H20ClNO3S/c1-14-6-11-18-20-13-21(25-29(26,27)16-9-7-15(24)8-10-16)17-4-2-3-5-19(17)23(20)28-22(18)12-14/h2-5,7-10,13-14,25H,6,11-12H2,1H3/t14-/m1/s1

InChI Key

BSZQPAYTTZRKDN-CQSZACIVSA-N

MDL Number (MFCD)

MFCD02345047

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.94

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.317

Distribution Coefficient, logD

6.280

Water Solubility, LogSw

-6.34

Polar Surface Area

48.267

Acid Dissociation Constant (pKa)

8.45

Base Dissociation Constant (pKb)

-8.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.70

3461-1688 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with 3461-1688 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3461-1688?
Check Price and Availability of 3461-1688, 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 3461-1688 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3461-1688
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3461-1688
  • 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 3461-1688 available by request