Y205-0063 Screening compound: 3,3-dimethyl-N~1~-[5-(2-thienyl)-1,3,4-thiadiazol-2-yl]butanamide

Y205-0063 Screening compound: 3,3-dimethyl-N~1~-[5-(2-thienyl)-1,3,4-thiadiazol-2-yl]butanamide
Y205-0063 Screening compound: 3,3-dimethyl-N~1~-[5-(2-thienyl)-1,3,4-thiadiazol-2-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y205-0063
3,3-dimethyl-N~1~-[5-(2-thienyl)-1,3,4-thiadiazol-2-yl]butanamide

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

Y205-0063

Molecular Formula

C12H15N3OS2 (C12 H15 N3 OS2)

Compound Name

3,3-dimethyl-N~1~-[5-(2-thienyl)-1,3,4-thiadiazol-2-yl]butanamide

IUPAC name

33-dimethyl-N-[5-(thiophen-2-yl)-134-thiadiazol-2-yl]butanamide

SMILES

CC(C)(C)CC(Nc1nnc(-c2cccs2)s1)=O

InChI

InChI=1S/C12H15N3OS2/c1-12(2,3)7-9(16)13-11-15-14-10(18-11)8-5-4-6-17-8/h4-6H,7H2,1-3H3,(H,13,15,16)

InChI Key

OYPOEZVOLGZFQV-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

281.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.813

Distribution Coefficient, logD

3.812

Water Solubility, LogSw

-3.92

Polar Surface Area

47.680

Acid Dissociation Constant (pKa)

10.03

Base Dissociation Constant (pKb)

-1.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.67

Y205-0063 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Kinases Annotated Library (2415 compounds)

Human Receptors Annotated Library (5376 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y205-0063 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y205-0063?
Check Price and Availability of Y205-0063, 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 Y205-0063 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y205-0063
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y205-0063
  • 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 Y205-0063 available by request