Y030-7124 Screening compound: 2-methoxy-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-(methylsulfanyl)benzamide

Y030-7124 Screening compound: 2-methoxy-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-(methylsulfanyl)benzamide
Y030-7124 Screening compound: 2-methoxy-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-(methylsulfanyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-7124
2-methoxy-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-(methylsulfanyl)benzamide

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

Y030-7124

Molecular Formula

C19H19N3O3S2 (C19 H19 N3 O3 S2)

Compound Name

2-methoxy-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-(methylsulfanyl)benzamide

IUPAC name

2-methoxy-N-{5-[(4-methoxyphenyl)methyl]-134-thiadiazol-2-yl}-4-(methylsulfanyl)benzamide

SMILES

COc1ccc(Cc2nnc(NC(c(ccc(SC)c3)c3OC)=O)s2)cc1

InChI

InChI=1S/C19H19N3O3S2/c1-24-13-6-4-12(5-7-13)10-17-21-22-19(27-17)20-18(23)15-9-8-14(26-3)11-16(15)25-2/h4-9,11H,10H2,1-3H3,(H,20,22,23)

InChI Key

QGHDAEPNWBIQDD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03352014

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.330

Distribution Coefficient, logD

3.128

Water Solubility, LogSw

-4.40

Polar Surface Area

62.272

Acid Dissociation Constant (pKa)

6.23

Base Dissociation Constant (pKb)

-3.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

Y030-7124 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Antimitotic Tubulin Library (17355 compounds)

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with Y030-7124 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-7124?
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What is the minimum amount of Y030-7124 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-7124
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-7124
  • 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 Y030-7124 available by request