6290-0107 Screening compound: 2-({5-butyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)-N-(4-oxo-4,5-dihydro-1,3-thiazol-2-yl)acetamide

6290-0107 Screening compound: 2-({5-butyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)-N-(4-oxo-4,5-dihydro-1,3-thiazol-2-yl)acetamide
6290-0107 Screening compound: 2-({5-butyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)-N-(4-oxo-4,5-dihydro-1,3-thiazol-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6290-0107
2-({5-butyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)-N-(4-oxo-4,5-dihydro-1,3-thiazol-2-yl)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

6290-0107

Molecular Formula

C18H18N6O2S2 (C18 H18 N6 O2 S2)

Compound Name

2-({5-butyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)-N-(4-oxo-4,5-dihydro-1,3-thiazol-2-yl)acetamide

IUPAC name

2-({5-butyl-5H-[124]triazino[56-b]indol-3-yl}sulfanyl)-N-(4-oxo-45-dihydro-13-thiazol-2-yl)acetamide

SMILES

CCCCn1c2nc(SCC(NC(SC3)=NC3=O)=O)nnc2c2c1cccc2

InChI

InChI=1S/C18H18N6O2S2/c1-2-3-8-24-12-7-5-4-6-11(12)15-16(24)21-18(23-22-15)28-10-14(26)20-17-19-13(25)9-27-17/h4-7H,2-3,8-10H2,1H3,(H,19,20,25,26)

InChI Key

TUGUCCIKOYXKBU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04128761

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.51

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.408

Distribution Coefficient, logD

2.309

Water Solubility, LogSw

-2.82

Polar Surface Area

78.794

Acid Dissociation Constant (pKa)

7.99

Base Dissociation Constant (pKb)

-0.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with 6290-0107 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6290-0107?
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What is the minimum amount of 6290-0107 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6290-0107
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6290-0107
  • 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 6290-0107 available by request