V017-0251 Screening compound: 1-{2-cyclopropyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}-4-(2-fluorobenzoyl)piperazine

V017-0251 Screening compound: 1-{2-cyclopropyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}-4-(2-fluorobenzoyl)piperazine
V017-0251 Screening compound: 1-{2-cyclopropyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}-4-(2-fluorobenzoyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-0251
1-{2-cyclopropyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}-4-(2-fluorobenzoyl)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

V017-0251

Molecular Formula

C22H23FN4OS (C22 H23 FN4 OS)

Compound Name

1-{2-cyclopropyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}-4-(2-fluorobenzoyl)piperazine

IUPAC name

1-{2-cyclopropyl-56-dimethylthieno[23-d]pyrimidin-4-yl}-4-(2-fluorobenzoyl)piperazine

SMILES

Cc1c(C)sc2nc(C3CC3)nc(N(CC3)CCN3C(c(cccc3)c3F)=O)c12

InChI

InChI=1S/C22H23FN4OS/c1-13-14(2)29-21-18(13)20(24-19(25-21)15-7-8-15)26-9-11-27(12-10-26)22(28)16-5-3-4-6-17(16)23/h3-6,15H,7-12H2,1-2H3

InChI Key

BZRWAJDPBHJNEM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03432043

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

410.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.002

Distribution Coefficient, logD

2.679

Water Solubility, LogSw

-4.83

Polar Surface Area

40.008

Acid Dissociation Constant (pKa)

22.46

Base Dissociation Constant (pKb)

9.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

V017-0251 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Nucleic Acid Ligands (8311 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with V017-0251 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-0251?
Check Price and Availability of V017-0251, 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 V017-0251 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-0251
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-0251
  • 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 V017-0251 available by request