M060-0210 Screening compound: 2-({8-methyl-5H-pyrimido[5,4-b]indol-4-yl}sulfanyl)-1-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one

M060-0210 Screening compound: 2-({8-methyl-5H-pyrimido[5,4-b]indol-4-yl}sulfanyl)-1-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one
M060-0210 Screening compound: 2-({8-methyl-5H-pyrimido[5,4-b]indol-4-yl}sulfanyl)-1-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound M060-0210
2-({8-methyl-5H-pyrimido[5,4-b]indol-4-yl}sulfanyl)-1-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one

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

M060-0210

Molecular Formula

C22H20N4OS (C22 H20 N4 OS)

Compound Name

2-({8-methyl-5H-pyrimido[5,4-b]indol-4-yl}sulfanyl)-1-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one

IUPAC name

2-({8-methyl-5H-pyrimido[54-b]indol-4-yl}sulfanyl)-1-(1234-tetrahydroisoquinolin-2-yl)ethan-1-one

SMILES

Cc(cc1)cc2c1[nH]c1c2ncnc1SCC(N(CC1)Cc2c1cccc2)=O

InChI

InChI=1S/C22H20N4OS/c1-14-6-7-18-17(10-14)20-21(25-18)22(24-13-23-20)28-12-19(27)26-9-8-15-4-2-3-5-16(15)11-26/h2-7,10,13,25H,8-9,11-12H2,1H3

InChI Key

DFSQUDTWMODIHS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27495058

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.068

Distribution Coefficient, logD

4.066

Water Solubility, LogSw

-4.04

Polar Surface Area

46.554

Acid Dissociation Constant (pKa)

17.91

Base Dissociation Constant (pKb)

5.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

M060-0210 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with M060-0210 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M060-0210?
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What is the minimum amount of M060-0210 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M060-0210
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M060-0210
  • 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 M060-0210 available by request