Y030-9845 Screening compound: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-pentanamidobenzamide

Y030-9845 Screening compound: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-pentanamidobenzamide
Y030-9845 Screening compound: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-pentanamidobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-9845
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-pentanamidobenzamide

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

Y030-9845

Molecular Formula

C18H24N4O2S (C18 H24 N4 O2 S)

Compound Name

N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-pentanamidobenzamide

IUPAC name

N-[5-(2-methylpropyl)-134-thiadiazol-2-yl]-4-pentanamidobenzamide

SMILES

CCCCC(Nc(cc1)ccc1C(Nc1nnc(CC(C)C)s1)=O)=O

InChI

InChI=1S/C18H24N4O2S/c1-4-5-6-15(23)19-14-9-7-13(8-10-14)17(24)20-18-22-21-16(25-18)11-12(2)3/h7-10,12H,4-6,11H2,1-3H3,(H,19,23)(H,20,22,24)

InChI Key

IWBQDJLMHNBGHC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04278488

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.080

Distribution Coefficient, logD

3.171

Water Solubility, LogSw

-4.02

Polar Surface Area

70.519

Acid Dissociation Constant (pKa)

6.55

Base Dissociation Constant (pKb)

-0.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

Y030-9845 in Drug Discovery

Included in Screening Libraries

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with Y030-9845 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-9845?
Check Price and Availability of Y030-9845, 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 Y030-9845 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-9845
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-9845
  • 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 Y030-9845 available by request