Y030-7182 Screening compound: 3-phenyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide

Y030-7182 Screening compound: 3-phenyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide
Y030-7182 Screening compound: 3-phenyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-7182
3-phenyl-N-[5-(trifluoromethyl)-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

Y030-7182

Molecular Formula

C13H12F3N3OS (C13 H12 F3 N3 OS)

Compound Name

3-phenyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide

IUPAC name

3-phenyl-N-[5-(trifluoromethyl)-134-thiadiazol-2-yl]butanamide

SMILES

CC(CC(Nc1nnc(C(F)(F)F)s1)=O)c1ccccc1

InChI

InChI=1S/C13H12F3N3OS/c1-8(9-5-3-2-4-6-9)7-10(20)17-12-19-18-11(21-12)13(14,15)16/h2-6,8H,7H2,1H3,(H,17,19,20)/t8-/m0/s1

InChI Key

GITQLUBCNIFZAP-QMMMGPOBSA-N

MDL Number (MFCD)

MFCD03352094

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.054

Distribution Coefficient, logD

1.501

Water Solubility, LogSw

-4.05

Polar Surface Area

46.661

Acid Dissociation Constant (pKa)

4.85

Base Dissociation Constant (pKb)

-4.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.80

Y030-7182 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system

References: we are preparing a list of scientific research reports with Y030-7182 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-7182?
Check Price and Availability of Y030-7182, 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 Y030-7182 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-7182
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-7182
  • 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 Y030-7182 available by request