M786-3323 Screening compound: 7-methyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-(1-pyrrolidinylcarbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione

M786-3323 Screening compound: 7-methyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-(1-pyrrolidinylcarbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
M786-3323 Screening compound: 7-methyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-(1-pyrrolidinylcarbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound M786-3323
7-methyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-(1-pyrrolidinylcarbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione

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

M786-3323

Molecular Formula

C17H19N5O4S (C17 H19 N5 O4 S)

Compound Name

7-methyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-(1-pyrrolidinylcarbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione

IUPAC name

7-methyl-1-[(3-methyl-124-oxadiazol-5-yl)methyl]-3-(pyrrolidine-1-carbonyl)-1H-4lambda612-benzothiadiazine-44-dione

SMILES

Cc1noc(CN(c2c3ccc(C)c2)N=C(C(N2CCCC2)=O)S3(=O)=O)n1

InChI

InChI=1S/C17H19N5O4S/c1-11-5-6-14-13(9-11)22(10-15-18-12(2)20-26-15)19-16(27(14,24)25)17(23)21-7-3-4-8-21/h5-6,9H,3-4,7-8,10H2,1-2H3

InChI Key

FEOJZJKSGZXCJE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27554166

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.44

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.287

Distribution Coefficient, logD

1.287

Water Solubility, LogSw

-2.35

Polar Surface Area

91.931

Acid Dissociation Constant (pKa)

24.52

Base Dissociation Constant (pKb)

-1.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

M786-3323 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with M786-3323 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M786-3323?
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What is the minimum amount of M786-3323 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M786-3323
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M786-3323
  • 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 M786-3323 available by request