Y040-9397 Screening compound: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-phenylthiophene-2-carboxamide

Y040-9397 Screening compound: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-phenylthiophene-2-carboxamide
Y040-9397 Screening compound: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-phenylthiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-9397
N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-phenylthiophene-2-carboxamide

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

Y040-9397

Molecular Formula

C16H13N3OS2 (C16 H13 N3 OS2)

Compound Name

N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-phenylthiophene-2-carboxamide

IUPAC name

N-(5-cyclopropyl-134-thiadiazol-2-yl)-5-phenylthiophene-2-carboxamide

SMILES

O=C(c1ccc(-c2ccccc2)s1)Nc1nnc(C2CC2)s1

InChI

InChI=1S/C16H13N3OS2/c20-14(17-16-19-18-15(22-16)11-6-7-11)13-9-8-12(21-13)10-4-2-1-3-5-10/h1-5,8-9,11H,6-7H2,(H,17,19,20)

InChI Key

KTRYFZBQYYWOOE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13759567

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.861

Distribution Coefficient, logD

4.802

Water Solubility, LogSw

-4.82

Polar Surface Area

47.873

Acid Dissociation Constant (pKa)

8.24

Base Dissociation Constant (pKb)

-2.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

References: we are preparing a list of scientific research reports with Y040-9397 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-9397?
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What is the minimum amount of Y040-9397 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-9397
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-9397
  • 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 Y040-9397 available by request