M073-0964 Screening compound: 5-methyl-N-[2-(2-methylpropanesulfonyl)-1,3-benzothiazol-6-yl]thiophene-2-carboxamide

M073-0964 Screening compound: 5-methyl-N-[2-(2-methylpropanesulfonyl)-1,3-benzothiazol-6-yl]thiophene-2-carboxamide
M073-0964 Screening compound: 5-methyl-N-[2-(2-methylpropanesulfonyl)-1,3-benzothiazol-6-yl]thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M073-0964
5-methyl-N-[2-(2-methylpropanesulfonyl)-1,3-benzothiazol-6-yl]thiophene-2-carboxamide

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

M073-0964

Molecular Formula

C17H18N2O3S3 (C17 H18 N2 O3 S3)

Compound Name

5-methyl-N-[2-(2-methylpropanesulfonyl)-1,3-benzothiazol-6-yl]thiophene-2-carboxamide

IUPAC name

5-methyl-N-[2-(2-methylpropanesulfonyl)-13-benzothiazol-6-yl]thiophene-2-carboxamide

SMILES

CC(C)CS(c1nc(ccc(NC(c2ccc(C)s2)=O)c2)c2s1)(=O)=O

InChI

InChI=1S/C17H18N2O3S3/c1-10(2)9-25(21,22)17-19-13-6-5-12(8-15(13)24-17)18-16(20)14-7-4-11(3)23-14/h4-8,10H,9H2,1-3H3,(H,18,20)

InChI Key

VHLSBWZYMZVNEP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27496118

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.877

Distribution Coefficient, logD

4.877

Water Solubility, LogSw

-4.57

Polar Surface Area

62.880

Acid Dissociation Constant (pKa)

10.83

Base Dissociation Constant (pKb)

-1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

M073-0964 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M073-0964 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M073-0964?
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What is the minimum amount of M073-0964 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M073-0964
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M073-0964
  • 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 M073-0964 available by request