K286-3616 Screening compound: 2-{[3-(2-methylphenyl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4',5':4,5]pyrimido[1,6-a][1,3]benzimidazol-5-yl]sulfanyl}-N~1~,N~1~-dipropylacetamide

K286-3616 Screening compound: 2-{[3-(2-methylphenyl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4',5':4,5]pyrimido[1,6-a][1,3]benzimidazol-5-yl]sulfanyl}-N~1~,N~1~-dipropylacetamide
K286-3616 Screening compound: 2-{[3-(2-methylphenyl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4',5':4,5]pyrimido[1,6-a][1,3]benzimidazol-5-yl]sulfanyl}-N~1~,N~1~-dipropylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K286-3616
2-{[3-(2-methylphenyl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4',5':4,5]pyrimido[1,6-a][1,3]benzimidazol-5-yl]sulfanyl}-N~1~,N~1~-dipropylacetamide

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

K286-3616

Molecular Formula

C26H27N5OS3 (C26 H27 N5 OS3)

Compound Name

2-{[3-(2-methylphenyl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4',5':4,5]pyrimido[1,6-a][1,3]benzimidazol-5-yl]sulfanyl}-N~1~,N~1~-dipropylacetamide

IUPAC name

2-{[5-(2-methylphenyl)-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}-NN-dipropylacetamide

SMILES

CCCN(CCC)C(CSc(n1c2nc3c1cccc3)nc(N1c3c(C)cccc3)c2SC1=S)=O

InChI

InChI=1S/C26H27N5OS3/c1-4-14-29(15-5-2)21(32)16-34-25-28-24-22(23-27-18-11-7-9-13-20(18)30(23)25)35-26(33)31(24)19-12-8-6-10-17(19)3/h6-13H,4-5,14-16H2,1-3H3

InChI Key

FYLGOHLGKJCINX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02935316

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

521.73

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.917

Distribution Coefficient, logD

5.914

Water Solubility, LogSw

-5.50

Polar Surface Area

38.534

Acid Dissociation Constant (pKa)

27.67

Base Dissociation Constant (pKb)

5.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

K286-3616 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with K286-3616 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K286-3616?
Check Price and Availability of K286-3616, 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 K286-3616 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K286-3616
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K286-3616
  • 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 K286-3616 available by request