0831-1248 Screening compound: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methylbenzamide

0831-1248 Screening compound: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methylbenzamide
0831-1248 Screening compound: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0831-1248
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methylbenzamide

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

0831-1248

Molecular Formula

C12H13N3OS (C12 H13 N3 OS)

Compound Name

N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methylbenzamide

IUPAC name

N-(5-ethyl-134-thiadiazol-2-yl)-2-methylbenzamide

SMILES

CCc1nnc(NC(c2c(C)cccc2)=O)s1

InChI

InChI=1S/C12H13N3OS/c1-3-10-14-15-12(17-10)13-11(16)9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3,(H,13,15,16)

InChI Key

GUXDOZOZPOKSPV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00992766

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

247.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.931

Distribution Coefficient, logD

1.713

Water Solubility, LogSw

-3.51

Polar Surface Area

47.370

Acid Dissociation Constant (pKa)

6.21

Base Dissociation Constant (pKb)

-1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 0831-1248 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0831-1248?
Check Price and Availability of 0831-1248, 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 0831-1248 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0831-1248
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0831-1248
  • 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 0831-1248 available by request