G675-0236 Screening compound: N2-{3-[benzyl(methyl)amino]propyl}-N5-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide

G675-0236 Screening compound: N2-{3-[benzyl(methyl)amino]propyl}-N5-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
G675-0236 Screening compound: N2-{3-[benzyl(methyl)amino]propyl}-N5-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G675-0236
N2-{3-[benzyl(methyl)amino]propyl}-N5-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide

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

G675-0236

Molecular Formula

C22H25N5O3S (C22 H25 N5 O3 S)

Compound Name

N2-{3-[benzyl(methyl)amino]propyl}-N5-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide

IUPAC name

N2-{3-[benzyl(methyl)amino]propyl}-N5-(4-methoxyphenyl)-134-thiadiazole-25-dicarboxamide

SMILES

CN(CCCNC(c1nnc(C(Nc(cc2)ccc2OC)=O)s1)=O)Cc1ccccc1

InChI

InChI=1S/C22H25N5O3S/c1-27(15-16-7-4-3-5-8-16)14-6-13-23-19(28)21-25-26-22(31-21)20(29)24-17-9-11-18(30-2)12-10-17/h3-5,7-12H,6,13-15H2,1-2H3,(H,23,28)(H,24,29)

InChI Key

KBRIZUXKNOYQBZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15028545

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.555

Distribution Coefficient, logD

1.114

Water Solubility, LogSw

-2.89

Polar Surface Area

82.726

Acid Dissociation Constant (pKa)

9.84

Base Dissociation Constant (pKb)

8.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

G675-0236 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with G675-0236 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G675-0236?
Check Price and Availability of G675-0236, 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 G675-0236 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G675-0236
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G675-0236
  • 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 G675-0236 available by request