V026-6145 Screening compound: 2-cyclopentyl-2-[4-(3-fluorobenzoyl)piperazino]-1-(1,4-thiazinan-4-yl)-1-ethanone

V026-6145 Screening compound: 2-cyclopentyl-2-[4-(3-fluorobenzoyl)piperazino]-1-(1,4-thiazinan-4-yl)-1-ethanone
V026-6145 Screening compound: 2-cyclopentyl-2-[4-(3-fluorobenzoyl)piperazino]-1-(1,4-thiazinan-4-yl)-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-6145
2-cyclopentyl-2-[4-(3-fluorobenzoyl)piperazino]-1-(1,4-thiazinan-4-yl)-1-ethanone

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

V026-6145

Molecular Formula

C22H30FN3O2S (C22 H30 FN3 O2 S)

Compound Name

2-cyclopentyl-2-[4-(3-fluorobenzoyl)piperazino]-1-(1,4-thiazinan-4-yl)-1-ethanone

IUPAC name

2-cyclopentyl-2-[4-(3-fluorobenzoyl)piperazin-1-yl]-1-(thiomorpholin-4-yl)ethan-1-one

SMILES

O=C(C(C1CCCC1)N(CC1)CCN1C(c1cc(F)ccc1)=O)N1CCSCC1

InChI

InChI=1S/C22H30FN3O2S/c23-19-7-3-6-18(16-19)21(27)25-10-8-24(9-11-25)20(17-4-1-2-5-17)22(28)26-12-14-29-15-13-26/h3,6-7,16-17,20H,1-2,4-5,8-15H2/t20-/m0/s1

InChI Key

OMVFNZHPYURGSR-FQEVSTJZSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

419.56

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.131

Distribution Coefficient, logD

2.131

Water Solubility, LogSw

-2.52

Polar Surface Area

36.926

Acid Dissociation Constant (pKa)

22.54

Base Dissociation Constant (pKb)

3.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.64

V026-6145 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 V026-6145 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-6145?
Check Price and Availability of V026-6145, 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 V026-6145 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-6145
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-6145
  • 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 V026-6145 available by request