M648-1181 Screening compound: 1-(5-chloro-3-methoxy-1-benzothiophene-2-carbonyl)-4-(3-methoxyphenyl)piperazine

M648-1181 Screening compound: 1-(5-chloro-3-methoxy-1-benzothiophene-2-carbonyl)-4-(3-methoxyphenyl)piperazine
M648-1181 Screening compound: 1-(5-chloro-3-methoxy-1-benzothiophene-2-carbonyl)-4-(3-methoxyphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound M648-1181
1-(5-chloro-3-methoxy-1-benzothiophene-2-carbonyl)-4-(3-methoxyphenyl)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

M648-1181

Molecular Formula

C21H21ClN2O3S (C21 H21 ClN2 O3 S)

Compound Name

1-(5-chloro-3-methoxy-1-benzothiophene-2-carbonyl)-4-(3-methoxyphenyl)piperazine

IUPAC name

1-(5-chloro-3-methoxy-1-benzothiophene-2-carbonyl)-4-(3-methoxyphenyl)piperazine

SMILES

COc1c(C(N(CC2)CCN2c2cc(OC)ccc2)=O)sc(cc2)c1cc2Cl

InChI

InChI=1S/C21H21ClN2O3S/c1-26-16-5-3-4-15(13-16)23-8-10-24(11-9-23)21(25)20-19(27-2)17-12-14(22)6-7-18(17)28-20/h3-7,12-13H,8-11H2,1-2H3

InChI Key

WDNFJYKHDYIIPB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27549921

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.93

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.842

Distribution Coefficient, logD

4.842

Water Solubility, LogSw

-4.87

Polar Surface Area

36.155

Acid Dissociation Constant (pKa)

28.47

Base Dissociation Constant (pKb)

5.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with M648-1181 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M648-1181?
Check Price and Availability of M648-1181, 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 M648-1181 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M648-1181
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M648-1181
  • 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 M648-1181 available by request