1067-0789 Screening compound: N-[5-({N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]hydrazinecarbonyl}methyl)-1,3,4-thiadiazol-2-yl]acetamide

1067-0789 Screening compound: N-[5-({N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]hydrazinecarbonyl}methyl)-1,3,4-thiadiazol-2-yl]acetamide
1067-0789 Screening compound: N-[5-({N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]hydrazinecarbonyl}methyl)-1,3,4-thiadiazol-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1067-0789
N-[5-({N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]hydrazinecarbonyl}methyl)-1,3,4-thiadiazol-2-yl]acetamide

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

1067-0789

Molecular Formula

C16H19N5O5S (C16 H19 N5 O5 S)

Compound Name

N-[5-({N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]hydrazinecarbonyl}methyl)-1,3,4-thiadiazol-2-yl]acetamide

IUPAC name

N-[5-({N'-[(E)-(345-trimethoxyphenyl)methylidene]hydrazinecarbonyl}methyl)-134-thiadiazol-2-yl]acetamide

SMILES

CC(Nc1nnc(CC(N/N=C/c(cc2OC)cc(OC)c2OC)=O)s1)=O

InChI

InChI=1S/C16H19N5O5S/c1-9(22)18-16-21-20-14(27-16)7-13(23)19-17-8-10-5-11(24-2)15(26-4)12(6-10)25-3/h5-6,8H,7H2,1-4H3,(H,19,23)(H,18,21,22)

InChI Key

AYOFMRCUYKIPMM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01536436

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.42

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.291

Distribution Coefficient, logD

1.280

Water Solubility, LogSw

-2.28

Polar Surface Area

105.621

Acid Dissociation Constant (pKa)

9.00

Base Dissociation Constant (pKb)

5.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

1067-0789 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1067-0789 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 1067-0789 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1067-0789
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1067-0789
  • 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 1067-0789 available by request