K286-0408 Screening compound: 2-{[3-(3-methoxyphenyl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4',5':4,5]pyrimido[1,6-a][1,3]benzimidazol-5-yl]sulfanyl}-1-(1-pyrrolidinyl)-1-ethanone

K286-0408 Screening compound: 2-{[3-(3-methoxyphenyl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4',5':4,5]pyrimido[1,6-a][1,3]benzimidazol-5-yl]sulfanyl}-1-(1-pyrrolidinyl)-1-ethanone
K286-0408 Screening compound: 2-{[3-(3-methoxyphenyl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4',5':4,5]pyrimido[1,6-a][1,3]benzimidazol-5-yl]sulfanyl}-1-(1-pyrrolidinyl)-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound K286-0408
2-{[3-(3-methoxyphenyl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4',5':4,5]pyrimido[1,6-a][1,3]benzimidazol-5-yl]sulfanyl}-1-(1-pyrrolidinyl)-1-ethanone

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

K286-0408

Molecular Formula

C24H21N5O2S3 (C24 H21 N5 O2 S3)

Compound Name

2-{[3-(3-methoxyphenyl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4',5':4,5]pyrimido[1,6-a][1,3]benzimidazol-5-yl]sulfanyl}-1-(1-pyrrolidinyl)-1-ethanone

IUPAC name

2-{[5-(3-methoxyphenyl)-4-sulfanylidene-3-thia-57916-tetraazatetracyclo[7.7.0.0^{26}.0^{1015}]hexadeca-1(16)2(6)710(15)1113-hexaen-8-yl]sulfanyl}-1-(pyrrolidin-1-yl)ethan-1-one

SMILES

COc1cccc(N(c(nc(n2c3nc4c2cccc4)SCC(N2CCCC2)=O)c3S2)C2=S)c1

InChI

InChI=1S/C24H21N5O2S3/c1-31-16-8-6-7-15(13-16)28-22-20(34-24(28)32)21-25-17-9-2-3-10-18(17)29(21)23(26-22)33-14-19(30)27-11-4-5-12-27/h2-3,6-10,13H,4-5,11-12,14H2,1H3

InChI Key

SKLYDHUCRWQCPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02935268

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

507.66

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.655

Distribution Coefficient, logD

4.653

Water Solubility, LogSw

-4.49

Polar Surface Area

46.953

Acid Dissociation Constant (pKa)

27.67

Base Dissociation Constant (pKb)

4.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with K286-0408 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K286-0408?
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What is the minimum amount of K286-0408 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K286-0408
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K286-0408
  • 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 K286-0408 available by request