M073-0945 Screening compound: N-[2-(isobutylsulfonyl)-1,3-benzothiazol-6-yl]-4-methylpentanamide

M073-0945 Screening compound: N-[2-(isobutylsulfonyl)-1,3-benzothiazol-6-yl]-4-methylpentanamide
M073-0945 Screening compound: N-[2-(isobutylsulfonyl)-1,3-benzothiazol-6-yl]-4-methylpentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M073-0945
N-[2-(isobutylsulfonyl)-1,3-benzothiazol-6-yl]-4-methylpentanamide

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

M073-0945

Molecular Formula

C17H24N2O3S2 (C17 H24 N2 O3 S2)

Compound Name

N-[2-(isobutylsulfonyl)-1,3-benzothiazol-6-yl]-4-methylpentanamide

IUPAC name

4-methyl-N-[2-(2-methylpropanesulfonyl)-13-benzothiazol-6-yl]pentanamide

SMILES

CC(C)CCC(Nc(cc1)cc(s2)c1nc2S(CC(C)C)(=O)=O)=O

InChI

InChI=1S/C17H24N2O3S2/c1-11(2)5-8-16(20)18-13-6-7-14-15(9-13)23-17(19-14)24(21,22)10-12(3)4/h6-7,9,11-12H,5,8,10H2,1-4H3,(H,18,20)

InChI Key

RXPXVYXUFCXYHS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27496113

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.523

Distribution Coefficient, logD

4.523

Water Solubility, LogSw

-4.27

Polar Surface Area

61.919

Acid Dissociation Constant (pKa)

11.06

Base Dissociation Constant (pKb)

-0.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.94

References: we are preparing a list of scientific research reports with M073-0945 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M073-0945?
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What is the minimum amount of M073-0945 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M073-0945
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M073-0945
  • 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 M073-0945 available by request