C712-1153 Screening compound: 2-(4-{4H-thieno[3,2-c]chromene-2-carbonyl}piperazin-1-yl)pyrimidine

C712-1153 Screening compound: 2-(4-{4H-thieno[3,2-c]chromene-2-carbonyl}piperazin-1-yl)pyrimidine
C712-1153 Screening compound: 2-(4-{4H-thieno[3,2-c]chromene-2-carbonyl}piperazin-1-yl)pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound C712-1153
2-(4-{4H-thieno[3,2-c]chromene-2-carbonyl}piperazin-1-yl)pyrimidine

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

C712-1153

Molecular Formula

C20H18N4O2S (C20 H18 N4 O2 S)

Compound Name

2-(4-{4H-thieno[3,2-c]chromene-2-carbonyl}piperazin-1-yl)pyrimidine

IUPAC name

2-(4-{4H-thieno[32-c]chromene-2-carbonyl}piperazin-1-yl)pyrimidine

SMILES

O=C(c1cc(COc2c-3cccc2)c3s1)N(CC1)CCN1c1ncccn1

InChI

InChI=1S/C20H18N4O2S/c25-19(23-8-10-24(11-9-23)20-21-6-3-7-22-20)17-12-14-13-26-16-5-2-1-4-15(16)18(14)27-17/h1-7,12H,8-11,13H2

InChI Key

BNAIFXYHBWBFGT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14787238

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.429

Distribution Coefficient, logD

3.429

Water Solubility, LogSw

-3.74

Polar Surface Area

47.626

Acid Dissociation Constant (pKa)

21.08

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

C712-1153 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C712-1153 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C712-1153?
Check Price and Availability of C712-1153, 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 C712-1153 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C712-1153
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C712-1153
  • 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 C712-1153 available by request