3448-1287 Screening compound: 1,3-dimethyl-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-diazinane-4,6-dione

3448-1287 Screening compound: 1,3-dimethyl-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-diazinane-4,6-dione
3448-1287 Screening compound: 1,3-dimethyl-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-diazinane-4,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3448-1287
1,3-dimethyl-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-diazinane-4,6-dione

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

3448-1287

Molecular Formula

C11H10N2O2S2 (C11 H10 N2 O2 S2)

Compound Name

1,3-dimethyl-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-diazinane-4,6-dione

IUPAC name

13-dimethyl-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-13-diazinane-46-dione

SMILES

CN(C(C(C(N1C)=O)=Cc2cccs2)=O)C1=S

InChI

InChI=1S/C11H10N2O2S2/c1-12-9(14)8(6-7-4-3-5-17-7)10(15)13(2)11(12)16/h3-6H,1-2H3

InChI Key

PRUHFDRJHVCLES-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01560592

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

266.34

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.708

Distribution Coefficient, logD

0.708

Water Solubility, LogSw

-1.79

Polar Surface Area

32.836

Acid Dissociation Constant (pKa)

35.69

Base Dissociation Constant (pKb)

-10.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with 3448-1287 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3448-1287?
Check Price and Availability of 3448-1287, 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 3448-1287 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3448-1287
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3448-1287
  • 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 3448-1287 available by request