K263-0048 Screening compound: ethyl 2-{[3-(2-furylmethyl)-8-nitro-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetate

K263-0048 Screening compound: ethyl 2-{[3-(2-furylmethyl)-8-nitro-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetate
K263-0048 Screening compound: ethyl 2-{[3-(2-furylmethyl)-8-nitro-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound K263-0048
ethyl 2-{[3-(2-furylmethyl)-8-nitro-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetate

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

K263-0048

Molecular Formula

C19H15N3O6S2 (C19 H15 N3 O6 S2)

Compound Name

ethyl 2-{[3-(2-furylmethyl)-8-nitro-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetate

IUPAC name

ethyl 2-({5-[(furan-2-yl)methyl]-12-nitro-6-oxo-8-thia-35-diazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)3911-pentaen-4-yl}sulfanyl)acetate

SMILES

CCOC(CSC(N(Cc1ccco1)C1=O)=Nc2c1sc(cc1)c2cc1[N+]([O-])=O)=O

InChI

InChI=1S/C19H15N3O6S2/c1-2-27-15(23)10-29-19-20-16-13-8-11(22(25)26)5-6-14(13)30-17(16)18(24)21(19)9-12-4-3-7-28-12/h3-8H,2,9-10H2,1H3

InChI Key

YQAKGWFAZHPDFQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15085336

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.48

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.965

Distribution Coefficient, logD

3.965

Water Solubility, LogSw

-3.96

Polar Surface Area

85.826

Acid Dissociation Constant (pKa)

29.82

Base Dissociation Constant (pKb)

-3.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

K263-0048 in Drug Discovery

Included in Screening Libraries

Human Kinases Annotated Library (2415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K263-0048 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K263-0048?
Check Price and Availability of K263-0048, 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 K263-0048 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K263-0048
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K263-0048
  • 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 K263-0048 available by request