M060-0077 Screening compound: N-(2,3-dimethylphenyl)-2-{5H-pyrimido[5,4-b]indol-4-ylsulfanyl}acetamide

M060-0077 Screening compound: N-(2,3-dimethylphenyl)-2-{5H-pyrimido[5,4-b]indol-4-ylsulfanyl}acetamide
M060-0077 Screening compound: N-(2,3-dimethylphenyl)-2-{5H-pyrimido[5,4-b]indol-4-ylsulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M060-0077
N-(2,3-dimethylphenyl)-2-{5H-pyrimido[5,4-b]indol-4-ylsulfanyl}acetamide

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

M060-0077

Molecular Formula

C20H18N4OS (C20 H18 N4 OS)

Compound Name

N-(2,3-dimethylphenyl)-2-{5H-pyrimido[5,4-b]indol-4-ylsulfanyl}acetamide

IUPAC name

N-(23-dimethylphenyl)-2-{5H-pyrimido[54-b]indol-4-ylsulfanyl}acetamide

SMILES

Cc1cccc(NC(CSc2ncnc3c2[nH]c2c3cccc2)=O)c1C

InChI

InChI=1S/C20H18N4OS/c1-12-6-5-9-15(13(12)2)23-17(25)10-26-20-19-18(21-11-22-20)14-7-3-4-8-16(14)24-19/h3-9,11,24H,10H2,1-2H3,(H,23,25)

InChI Key

BRJFSMRULBEFMO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15140076

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.010

Distribution Coefficient, logD

4.009

Water Solubility, LogSw

-4.21

Polar Surface Area

52.951

Acid Dissociation Constant (pKa)

12.69

Base Dissociation Constant (pKb)

4.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with M060-0077 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M060-0077?
Check Price and Availability of M060-0077, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of M060-0077 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M060-0077
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M060-0077
  • 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 M060-0077 available by request