1067-1126 Screening compound: (2E)-2-{[5-(3-chloro-4-methylphenyl)furan-2-yl]methylidene}hydrazin-1-yl 2-(5-amino-1,3,4-thiadiazol-2-yl)acetate

1067-1126 Screening compound: (2E)-2-{[5-(3-chloro-4-methylphenyl)furan-2-yl]methylidene}hydrazin-1-yl 2-(5-amino-1,3,4-thiadiazol-2-yl)acetate
1067-1126 Screening compound: (2E)-2-{[5-(3-chloro-4-methylphenyl)furan-2-yl]methylidene}hydrazin-1-yl 2-(5-amino-1,3,4-thiadiazol-2-yl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1067-1126
(2E)-2-{[5-(3-chloro-4-methylphenyl)furan-2-yl]methylidene}hydrazin-1-yl 2-(5-amino-1,3,4-thiadiazol-2-yl)acetate

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

1067-1126

Molecular Formula

C16H14ClN5O3S (C16 H14 ClN5 O3 S)

Compound Name

(2E)-2-{[5-(3-chloro-4-methylphenyl)furan-2-yl]methylidene}hydrazin-1-yl 2-(5-amino-1,3,4-thiadiazol-2-yl)acetate

IUPAC name

(2E)-2-{[5-(3-chloro-4-methylphenyl)furan-2-yl]methylidene}hydrazin-1-yl 2-(5-amino-134-thiadiazol-2-yl)acetate

SMILES

Cc(ccc(-c1ccc(/C=N/NOC(Cc2nnc(N)s2)=O)o1)c1)c1Cl

InChI

InChI=1S/C16H14ClN5O3S/c1-9-2-3-10(6-12(9)17)13-5-4-11(24-13)8-19-22-25-15(23)7-14-20-21-16(18)26-14/h2-6,8,22H,7H2,1H3,(H2,18,21)

InChI Key

DRFFXDJYQPUXIT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01536438

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.84

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.806

Distribution Coefficient, logD

2.655

Water Solubility, LogSw

-3.52

Polar Surface Area

95.070

Acid Dissociation Constant (pKa)

10.59

Base Dissociation Constant (pKb)

-4.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

1067-1126 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 1067-1126 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 1067-1126 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1067-1126
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1067-1126
  • 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 1067-1126 available by request