Y031-3041 Screening compound: 4-methoxy-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide

Y031-3041 Screening compound: 4-methoxy-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
Y031-3041 Screening compound: 4-methoxy-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-3041
4-methoxy-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}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

Y031-3041

Molecular Formula

C19H19N3O3S (C19 H19 N3 O3 S)

Compound Name

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

IUPAC name

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

SMILES

COc1ccc(CCc2nnc(NC(c(cc3)ccc3OC)=O)s2)cc1

InChI

InChI=1S/C19H19N3O3S/c1-24-15-8-3-13(4-9-15)5-12-17-21-22-19(26-17)20-18(23)14-6-10-16(25-2)11-7-14/h3-4,6-11H,5,12H2,1-2H3,(H,20,22,23)

InChI Key

QBBLYQLDOZXZDH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07150264

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.228

Distribution Coefficient, logD

3.733

Water Solubility, LogSw

-4.25

Polar Surface Area

62.186

Acid Dissociation Constant (pKa)

7.07

Base Dissociation Constant (pKb)

-3.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.05

References: we are preparing a list of scientific research reports with Y031-3041 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-3041?
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What is the minimum amount of Y031-3041 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-3041
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-3041
  • 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 Y031-3041 available by request