V012-2371 Screening compound: 1-{2-cyclopropyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}-4-(2,4-dichlorobenzoyl)piperazine

V012-2371 Screening compound: 1-{2-cyclopropyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}-4-(2,4-dichlorobenzoyl)piperazine
V012-2371 Screening compound: 1-{2-cyclopropyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}-4-(2,4-dichlorobenzoyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-2371
1-{2-cyclopropyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}-4-(2,4-dichlorobenzoyl)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

V012-2371

Molecular Formula

C22H22Cl2N4OS (C22 H22 Cl2 N4 OS)

Compound Name

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

IUPAC name

1-{2-cyclopropyl-56-dimethylthieno[23-d]pyrimidin-4-yl}-4-(24-dichlorobenzoyl)piperazine

SMILES

Cc1c(C)sc2c1c(N(CC1)CCN1C(c(ccc(Cl)c1)c1Cl)=O)nc(C1CC1)n2

InChI

InChI=1S/C22H22Cl2N4OS/c1-12-13(2)30-21-18(12)20(25-19(26-21)14-3-4-14)27-7-9-28(10-8-27)22(29)16-6-5-15(23)11-17(16)24/h5-6,11,14H,3-4,7-10H2,1-2H3

InChI Key

QTWQAOLXRFRWCM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19845569

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

461.41

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

6.001

Distribution Coefficient, logD

3.678

Water Solubility, LogSw

-6.14

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

V012-2371 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V012-2371 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-2371?
Check Price and Availability of V012-2371, 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 V012-2371 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-2371
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-2371
  • 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 V012-2371 available by request