C355-0574 Screening compound: (6Z)-3-(ethanesulfonyl)-6-[(furan-2-yl)methylidene]-5-imino-5H,6H,7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one

C355-0574 Screening compound: (6Z)-3-(ethanesulfonyl)-6-[(furan-2-yl)methylidene]-5-imino-5H,6H,7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
C355-0574 Screening compound: (6Z)-3-(ethanesulfonyl)-6-[(furan-2-yl)methylidene]-5-imino-5H,6H,7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C355-0574
(6Z)-3-(ethanesulfonyl)-6-[(furan-2-yl)methylidene]-5-imino-5H,6H,7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one

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

C355-0574

Molecular Formula

C12H10N4O4S2 (C12 H10 N4 O4 S2)

Compound Name

(6Z)-3-(ethanesulfonyl)-6-[(furan-2-yl)methylidene]-5-imino-5H,6H,7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one

IUPAC name

(6Z)-3-(ethanesulfonyl)-6-[(furan-2-yl)methylidene]-5-imino-5H6H7H-[124]thiadiazolo[45-a]pyrimidin-7-one

SMILES

CCS(C(N1C(/C2=C/c3ccco3)=N)=NSC1=NC2=O)(=O)=O

InChI

InChI=1S/C12H10N4O4S2/c1-2-22(18,19)12-15-21-11-14-10(17)8(9(13)16(11)12)6-7-4-3-5-20-7/h3-6,13H,2H2,1H3

InChI Key

XOEXUIIWIFLIEQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14751387

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.37

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.335

Distribution Coefficient, logD

0.333

Water Solubility, LogSw

-2.22

Polar Surface Area

88.056

Acid Dissociation Constant (pKa)

22.01

Base Dissociation Constant (pKb)

5.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with C355-0574 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C355-0574?
Check Price and Availability of C355-0574, 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 C355-0574 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C355-0574
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C355-0574
  • 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 C355-0574 available by request