Y200-3543 Screening compound: 1-(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)-4-(2-phenylethyl)piperazine

Y200-3543 Screening compound: 1-(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)-4-(2-phenylethyl)piperazine
Y200-3543 Screening compound: 1-(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)-4-(2-phenylethyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y200-3543
1-(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)-4-(2-phenylethyl)piperazine

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

Y200-3543

Molecular Formula

C22H23ClN2OS (C22 H23 ClN2 OS)

Compound Name

1-(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)-4-(2-phenylethyl)piperazine

IUPAC name

1-(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)-4-(2-phenylethyl)piperazine

SMILES

Cc(cc1)cc2c1c(Cl)c(C(N1CCN(CCc3ccccc3)CC1)=O)s2

InChI

InChI=1S/C22H23ClN2OS/c1-16-7-8-18-19(15-16)27-21(20(18)23)22(26)25-13-11-24(12-14-25)10-9-17-5-3-2-4-6-17/h2-8,15H,9-14H2,1H3

InChI Key

WRLLBFKUPZJXJZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04058467

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.96

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.168

Distribution Coefficient, logD

5.140

Water Solubility, LogSw

-5.59

Polar Surface Area

21.152

Acid Dissociation Constant (pKa)

26.47

Base Dissociation Constant (pKb)

6.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

Y200-3543 in Drug Discovery

Included in Screening Libraries

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

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with Y200-3543 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y200-3543?
Check Price and Availability of Y200-3543, 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 Y200-3543 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y200-3543
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y200-3543
  • 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 Y200-3543 available by request