M676-1380 Screening compound: N-({2-[1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidin-3-yl]-1,3-thiazol-4-yl}methyl)acetamide

M676-1380 Screening compound: N-({2-[1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidin-3-yl]-1,3-thiazol-4-yl}methyl)acetamide
M676-1380 Screening compound: N-({2-[1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidin-3-yl]-1,3-thiazol-4-yl}methyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M676-1380
N-({2-[1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidin-3-yl]-1,3-thiazol-4-yl}methyl)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

M676-1380

Molecular Formula

C17H19N5O3S3 (C17 H19 N5 O3 S3)

Compound Name

N-({2-[1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidin-3-yl]-1,3-thiazol-4-yl}methyl)acetamide

IUPAC name

N-({2-[1-(213-benzothiadiazole-4-sulfonyl)piperidin-3-yl]-13-thiazol-4-yl}methyl)acetamide

SMILES

CC(NCc1csc(C(CCC2)CN2S(c2cccc3nsnc23)(=O)=O)n1)=O

InChI

InChI=1S/C17H19N5O3S3/c1-11(23)18-8-13-10-26-17(19-13)12-4-3-7-22(9-12)28(24,25)15-6-2-5-14-16(15)21-27-20-14/h2,5-6,10,12H,3-4,7-9H2,1H3,(H,18,23)/t12-/m0/s1

InChI Key

GPHCGZZIWNIJDF-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD27550875

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.57

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.509

Distribution Coefficient, logD

1.509

Water Solubility, LogSw

-2.27

Polar Surface Area

87.649

Acid Dissociation Constant (pKa)

14.81

Base Dissociation Constant (pKb)

1.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.20

M676-1380 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Mimetics

References: we are preparing a list of scientific research reports with M676-1380 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M676-1380?
Check Price and Availability of M676-1380, 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 M676-1380 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M676-1380
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M676-1380
  • 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 M676-1380 available by request