V016-8460 Screening compound: 1-{4-[(4-bromophenyl)methyl]-2-methyl-4H-thieno[3,2-b]pyrrole-5-carbonyl}-4-methylpiperazine

V016-8460 Screening compound: 1-{4-[(4-bromophenyl)methyl]-2-methyl-4H-thieno[3,2-b]pyrrole-5-carbonyl}-4-methylpiperazine
V016-8460 Screening compound: 1-{4-[(4-bromophenyl)methyl]-2-methyl-4H-thieno[3,2-b]pyrrole-5-carbonyl}-4-methylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-8460
1-{4-[(4-bromophenyl)methyl]-2-methyl-4H-thieno[3,2-b]pyrrole-5-carbonyl}-4-methylpiperazine

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

V016-8460

Molecular Formula

C20H22BrN3OS (C20 H22 BrN3 OS)

Compound Name

1-{4-[(4-bromophenyl)methyl]-2-methyl-4H-thieno[3,2-b]pyrrole-5-carbonyl}-4-methylpiperazine

IUPAC name

1-{4-[(4-bromophenyl)methyl]-2-methyl-4H-thieno[32-b]pyrrole-5-carbonyl}-4-methylpiperazine

SMILES

Cc1cc(n(Cc(cc2)ccc2Br)c(C(N2CCN(C)CC2)=O)c2)c2s1

InChI

InChI=1S/C20H22BrN3OS/c1-14-11-17-19(26-14)12-18(20(25)23-9-7-22(2)8-10-23)24(17)13-15-3-5-16(21)6-4-15/h3-6,11-12H,7-10,13H2,1-2H3

InChI Key

KCBCWPLYMBVSTK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19910346

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

432.38

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.454

Distribution Coefficient, logD

4.323

Water Solubility, LogSw

-4.28

Polar Surface Area

21.836

Acid Dissociation Constant (pKa)

25.97

Base Dissociation Constant (pKb)

6.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

V016-8460 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V016-8460 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-8460?
Check Price and Availability of V016-8460, 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 V016-8460 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-8460
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-8460
  • 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 V016-8460 available by request