5910-0183 Screening compound: [4-amino-6-(phenylamino)-1,3,5-triazin-2-yl]methyl 4-phenylpiperazine-1-carbodithioate

5910-0183 Screening compound: [4-amino-6-(phenylamino)-1,3,5-triazin-2-yl]methyl 4-phenylpiperazine-1-carbodithioate
5910-0183 Screening compound: [4-amino-6-(phenylamino)-1,3,5-triazin-2-yl]methyl 4-phenylpiperazine-1-carbodithioate alternative view

Chemical Structure Depiction of ChemDiv screening compound 5910-0183
[4-amino-6-(phenylamino)-1,3,5-triazin-2-yl]methyl 4-phenylpiperazine-1-carbodithioate

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

5910-0183

Molecular Formula

C21H23N7S2 (C21 H23 N7 S2)

Compound Name

[4-amino-6-(phenylamino)-1,3,5-triazin-2-yl]methyl 4-phenylpiperazine-1-carbodithioate

IUPAC name

[4-amino-6-(phenylamino)-135-triazin-2-yl]methyl 4-phenylpiperazine-1-carbodithioate

SMILES

Nc1nc(CSC(N(CC2)CCN2c2ccccc2)=S)nc(Nc2ccccc2)n1

InChI

InChI=1S/C21H23N7S2/c22-19-24-18(25-20(26-19)23-16-7-3-1-4-8-16)15-30-21(29)28-13-11-27(12-14-28)17-9-5-2-6-10-17/h1-10H,11-15H2,(H3,22,23,24,25,26)

InChI Key

MJUBMNNENZFDBB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03615487

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.59

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.371

Distribution Coefficient, logD

4.368

Water Solubility, LogSw

-4.36

Polar Surface Area

67.689

Acid Dissociation Constant (pKa)

17.64

Base Dissociation Constant (pKb)

5.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

5910-0183 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 5910-0183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5910-0183?
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What is the minimum amount of 5910-0183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5910-0183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5910-0183
  • 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 5910-0183 available by request