2237-2232 Screening compound: 4-[(E)-{[2-(5-amino-1,3,4-thiadiazol-2-yl)acetamido]imino}methyl]-2-methoxyphenyl furan-2-carboxylate

2237-2232 Screening compound: 4-[(E)-{[2-(5-amino-1,3,4-thiadiazol-2-yl)acetamido]imino}methyl]-2-methoxyphenyl furan-2-carboxylate
2237-2232 Screening compound: 4-[(E)-{[2-(5-amino-1,3,4-thiadiazol-2-yl)acetamido]imino}methyl]-2-methoxyphenyl furan-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2237-2232
4-[(E)-{[2-(5-amino-1,3,4-thiadiazol-2-yl)acetamido]imino}methyl]-2-methoxyphenyl furan-2-carboxylate

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

2237-2232

Molecular Formula

C17H15N5O5S (C17 H15 N5 O5 S)

Compound Name

4-[(E)-{[2-(5-amino-1,3,4-thiadiazol-2-yl)acetamido]imino}methyl]-2-methoxyphenyl furan-2-carboxylate

IUPAC name

4-[(E)-{[2-(5-amino-134-thiadiazol-2-yl)acetamido]imino}methyl]-2-methoxyphenyl furan-2-carboxylate

SMILES

COc(cc(/C=N/NC(Cc1nnc(N)s1)=O)cc1)c1OC(c1ccco1)=O

InChI

InChI=1S/C17H15N5O5S/c1-25-13-7-10(4-5-11(13)27-16(24)12-3-2-6-26-12)9-19-20-14(23)8-15-21-22-17(18)28-15/h2-7,9H,8H2,1H3,(H2,18,22)(H,20,23)

InChI Key

AEXWTWMUHJMNBQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01081099

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.4

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.118

Distribution Coefficient, logD

1.118

Water Solubility, LogSw

-2.29

Polar Surface Area

116.811

Acid Dissociation Constant (pKa)

10.99

Base Dissociation Constant (pKb)

2.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

References: we are preparing a list of scientific research reports with 2237-2232 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2237-2232?
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What is the minimum amount of 2237-2232 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2237-2232
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2237-2232
  • 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 2237-2232 available by request