8015-7847 Screening compound: 9-cyclopropyl-7-(trifluoromethyl)pyrido[2',3':4,5]thieno[2,3-b]pyridine-2,4-diol

8015-7847 Screening compound: 9-cyclopropyl-7-(trifluoromethyl)pyrido[2',3':4,5]thieno[2,3-b]pyridine-2,4-diol
8015-7847 Screening compound: 9-cyclopropyl-7-(trifluoromethyl)pyrido[2',3':4,5]thieno[2,3-b]pyridine-2,4-diol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-7847
9-cyclopropyl-7-(trifluoromethyl)pyrido[2',3':4,5]thieno[2,3-b]pyridine-2,4-diol

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

8015-7847

Molecular Formula

C14H9F3N2O2S (C14 H9 F3 N2 O2 S)

Compound Name

9-cyclopropyl-7-(trifluoromethyl)pyrido[2',3':4,5]thieno[2,3-b]pyridine-2,4-diol

IUPAC name

13-cyclopropyl-11-(trifluoromethyl)-8-thia-310-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)351012-hexaene-46-diol

SMILES

Oc1c2sc3nc(C(F)(F)F)cc(C4CC4)c3c2nc(O)c1

InChI

InChI=1S/C14H9F3N2O2S/c15-14(16,17)8-3-6(5-1-2-5)10-11-12(22-13(10)18-8)7(20)4-9(21)19-11/h3-5H,1-2H2,(H2,19,20,21)

InChI Key

ANDSLDADBVQUAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05258340

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.047

Distribution Coefficient, logD

3.843

Water Solubility, LogSw

-4.08

Polar Surface Area

53.119

Acid Dissociation Constant (pKa)

7.62

Base Dissociation Constant (pKb)

1.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.57

8015-7847 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

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

NOTUM (Wnt signaling) Library (3881 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 8015-7847 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-7847?
Check Price and Availability of 8015-7847, 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 8015-7847 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-7847
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-7847
  • 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 8015-7847 available by request