1766-1188 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-5-(methoxymethyl)-1H-1,2,3-triazole-4-carbohydrazide

1766-1188 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-5-(methoxymethyl)-1H-1,2,3-triazole-4-carbohydrazide
1766-1188 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-5-(methoxymethyl)-1H-1,2,3-triazole-4-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1766-1188
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-5-(methoxymethyl)-1H-1,2,3-triazole-4-carbohydrazide

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

1766-1188

Molecular Formula

C16H18N8O5 (C16 H18 N8 O5)

Compound Name

1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-5-(methoxymethyl)-1H-1,2,3-triazole-4-carbohydrazide

IUPAC name

1-(4-amino-125-oxadiazol-3-yl)-N'-[(E)-(23-dimethoxyphenyl)methylidene]-5-(methoxymethyl)-1H-123-triazole-4-carbohydrazide

SMILES

COCc1c(C(N/N=C/c(cccc2OC)c2OC)=O)nnn1-c1nonc1N

InChI

InChI=1S/C16H18N8O5/c1-26-8-10-12(19-23-24(10)15-14(17)21-29-22-15)16(25)20-18-7-9-5-4-6-11(27-2)13(9)28-3/h4-7H,8H2,1-3H3,(H2,17,21)(H,20,25)

InChI Key

STZCWTBFUUFZEG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01247052

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.37

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

13

Partition Coefficient, logP

1.054

Distribution Coefficient, logD

1.053

Water Solubility, LogSw

-1.94

Polar Surface Area

141.926

Acid Dissociation Constant (pKa)

9.93

Base Dissociation Constant (pKb)

0.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 1766-1188 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1766-1188
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Delivery formats for 1766-1188
  • 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 1766-1188 available by request