V021-3090 Screening compound: N-{2-(CYCLOPROPYLAMINO)-2-OXO-1-[1-(2-THIENYLCARBONYL)-4-PIPERIDYL]ETHYL}-4-FLUOROBENZAMIDE

V021-3090 Screening compound: N-{2-(CYCLOPROPYLAMINO)-2-OXO-1-[1-(2-THIENYLCARBONYL)-4-PIPERIDYL]ETHYL}-4-FLUOROBENZAMIDE
V021-3090 Screening compound: N-{2-(CYCLOPROPYLAMINO)-2-OXO-1-[1-(2-THIENYLCARBONYL)-4-PIPERIDYL]ETHYL}-4-FLUOROBENZAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-3090
N-{2-(CYCLOPROPYLAMINO)-2-OXO-1-[1-(2-THIENYLCARBONYL)-4-PIPERIDYL]ETHYL}-4-FLUOROBENZAMIDE

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

V021-3090

Molecular Formula

C22H24FN3O3S (C22 H24 FN3 O3 S)

Compound Name

N-{2-(CYCLOPROPYLAMINO)-2-OXO-1-[1-(2-THIENYLCARBONYL)-4-PIPERIDYL]ETHYL}-4-FLUOROBENZAMIDE

IUPAC name

n/a

SMILES

O=C(C(C(CC1)CCN1C(c1cccs1)=O)NC(c(cc1)ccc1F)=O)NC1CC1

InChI

InChI=1S/C22H24FN3O3S/c23-16-5-3-15(4-6-16)20(27)25-19(21(28)24-17-7-8-17)14-9-11-26(12-10-14)22(29)18-2-1-13-30-18/h1-6,13-14,17,19H,7-12H2,(H,24,28)(H,25,27)/t19-/m0/s1

InChI Key

RJJSBTWAUJYSKW-IBGZPJMESA-N

MDL Number (MFCD)

MFCD19874292

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.887

Distribution Coefficient, logD

2.887

Water Solubility, LogSw

-3.34

Polar Surface Area

66.140

Acid Dissociation Constant (pKa)

11.00

Base Dissociation Constant (pKb)

1.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

V021-3090 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V021-3090 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-3090?
Check Price and Availability of V021-3090, 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 V021-3090 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-3090
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-3090
  • 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 V021-3090 available by request