6623-1163 Screening compound: 2-({5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)-1-(10H-phenothiazin-10-yl)butan-1-one

6623-1163 Screening compound: 2-({5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)-1-(10H-phenothiazin-10-yl)butan-1-one
6623-1163 Screening compound: 2-({5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)-1-(10H-phenothiazin-10-yl)butan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6623-1163
2-({5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)-1-(10H-phenothiazin-10-yl)butan-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

6623-1163

Molecular Formula

C26H21N5OS2 (C26 H21 N5 OS2)

Compound Name

2-({5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)-1-(10H-phenothiazin-10-yl)butan-1-one

IUPAC name

2-({5-methyl-5H-[124]triazino[56-b]indol-3-yl}sulfanyl)-1-(10H-phenothiazin-10-yl)butan-1-one

SMILES

CCC(C(N1c(cccc2)c2Sc2c1cccc2)=O)Sc1nnc(c(cccc2)c2n2C)c2n1

InChI

InChI=1S/C26H21N5OS2/c1-3-20(34-26-27-24-23(28-29-26)16-10-4-5-11-17(16)30(24)2)25(32)31-18-12-6-8-14-21(18)33-22-15-9-7-13-19(22)31/h4-15,20H,3H2,1-2H3/t20-/m0/s1

InChI Key

TWTXTVAMKIFEPY-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD01460430

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.599

Distribution Coefficient, logD

5.599

Water Solubility, LogSw

-5.70

Polar Surface Area

47.691

Acid Dissociation Constant (pKa)

12.23

Base Dissociation Constant (pKb)

0.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with 6623-1163 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6623-1163?
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What is the minimum amount of 6623-1163 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6623-1163
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6623-1163
  • 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 6623-1163 available by request