3627-0350 Screening compound: 3,5-bis({2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido})benzoic acid

3627-0350 Screening compound: 3,5-bis({2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido})benzoic acid
3627-0350 Screening compound: 3,5-bis({2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido})benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 3627-0350
3,5-bis({2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido})benzoic acid

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

3627-0350

Molecular Formula

C17H16N6O4S4 (C17 H16 N6 O4 S4)

Compound Name

3,5-bis({2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido})benzoic acid

IUPAC name

35-bis({2-[(5-methyl-134-thiadiazol-2-yl)sulfanyl]acetamido})benzoic acid

SMILES

Cc1nnc(SCC(Nc2cc(C(O)=O)cc(NC(CSc3nnc(C)s3)=O)c2)=O)s1

InChI

InChI=1S/C17H16N6O4S4/c1-8-20-22-16(30-8)28-6-13(24)18-11-3-10(15(26)27)4-12(5-11)19-14(25)7-29-17-23-21-9(2)31-17/h3-5H,6-7H2,1-2H3,(H,18,24)(H,19,25)(H,26,27)

InChI Key

UTPVTOWIQJXVIO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01443559

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.62

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.366

Distribution Coefficient, logD

-0.016

Water Solubility, LogSw

-2.55

Polar Surface Area

119.745

Acid Dissociation Constant (pKa)

5.02

Base Dissociation Constant (pKb)

-1.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with 3627-0350 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3627-0350?
Check Price and Availability of 3627-0350, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3627-0350 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3627-0350
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3627-0350
  • 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 3627-0350 available by request