V013-2446 Screening compound: [4-(5,6-dimethyl-2-phenethylthieno[2,3-d]pyrimidin-4-yl)piperazino](4-fluorophenyl)methanone

V013-2446 Screening compound: [4-(5,6-dimethyl-2-phenethylthieno[2,3-d]pyrimidin-4-yl)piperazino](4-fluorophenyl)methanone
V013-2446 Screening compound: [4-(5,6-dimethyl-2-phenethylthieno[2,3-d]pyrimidin-4-yl)piperazino](4-fluorophenyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-2446
[4-(5,6-dimethyl-2-phenethylthieno[2,3-d]pyrimidin-4-yl)piperazino](4-fluorophenyl)methanone

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

V013-2446

Molecular Formula

C27H27FN4OS (C27 H27 FN4 OS)

Compound Name

[4-(5,6-dimethyl-2-phenethylthieno[2,3-d]pyrimidin-4-yl)piperazino](4-fluorophenyl)methanone

IUPAC name

1-[56-dimethyl-2-(2-phenylethyl)thieno[23-d]pyrimidin-4-yl]-4-(4-fluorobenzoyl)piperazine

SMILES

Cc1c(C)sc2nc(CCc3ccccc3)nc(N(CC3)CCN3C(c(cc3)ccc3F)=O)c12

InChI

InChI=1S/C27H27FN4OS/c1-18-19(2)34-26-24(18)25(29-23(30-26)13-8-20-6-4-3-5-7-20)31-14-16-32(17-15-31)27(33)21-9-11-22(28)12-10-21/h3-7,9-12H,8,13-17H2,1-2H3

InChI Key

VQCJYOVQZPERJR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19845627

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

474.6

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.146

Distribution Coefficient, logD

5.309

Water Solubility, LogSw

-5.88

Polar Surface Area

40.475

Acid Dissociation Constant (pKa)

22.46

Base Dissociation Constant (pKb)

8.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

V013-2446 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V013-2446 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-2446?
Check Price and Availability of V013-2446, 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 V013-2446 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-2446
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-2446
  • 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 V013-2446 available by request