M070-0340 Screening compound: 3-methyl-2-oxo-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide

M070-0340 Screening compound: 3-methyl-2-oxo-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
M070-0340 Screening compound: 3-methyl-2-oxo-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M070-0340
3-methyl-2-oxo-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide

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

M070-0340

Molecular Formula

C18H17N3O4S3 (C18 H17 N3 O4 S3)

Compound Name

3-methyl-2-oxo-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide

IUPAC name

3-methyl-2-oxo-N-[2-(propylsulfanyl)-13-benzothiazol-6-yl]-23-dihydro-13-benzoxazole-6-sulfonamide

SMILES

CCCSc1nc(ccc(NS(c(cc2)cc(O3)c2N(C)C3=O)(=O)=O)c2)c2s1

InChI

InChI=1S/C18H17N3O4S3/c1-3-8-26-17-19-13-6-4-11(9-16(13)27-17)20-28(23,24)12-5-7-14-15(10-12)25-18(22)21(14)2/h4-7,9-10,20H,3,8H2,1-2H3

InChI Key

VZYBVWMQVIWGIT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27495514

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.185

Distribution Coefficient, logD

4.178

Water Solubility, LogSw

-4.32

Polar Surface Area

72.835

Acid Dissociation Constant (pKa)

9.23

Base Dissociation Constant (pKb)

0.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

M070-0340 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with M070-0340 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M070-0340?
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What is the minimum amount of M070-0340 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M070-0340
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M070-0340
  • 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 M070-0340 available by request