8002-4818 Screening compound: 2-[(E)-{2-[4-(morpholin-4-yl)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-4-nitrophenol

8002-4818 Screening compound: 2-[(E)-{2-[4-(morpholin-4-yl)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-4-nitrophenol
8002-4818 Screening compound: 2-[(E)-{2-[4-(morpholin-4-yl)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-4-nitrophenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-4818
2-[(E)-{2-[4-(morpholin-4-yl)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-4-nitrophenol

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

8002-4818

Molecular Formula

C18H22N8O4 (C18 H22 N8 O4)

Compound Name

2-[(E)-{2-[4-(morpholin-4-yl)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-4-nitrophenol

IUPAC name

2-[(E)-{2-[4-(morpholin-4-yl)-6-(pyrrolidin-1-yl)-135-triazin-2-yl]hydrazin-1-ylidene}methyl]-4-nitrophenol

SMILES

[O-][N+](c(cc1)cc(/C=N/Nc2nc(N3CCOCC3)nc(N3CCCC3)n2)c1O)=O

InChI

InChI=1S/C18H22N8O4/c27-15-4-3-14(26(28)29)11-13(15)12-19-23-16-20-17(24-5-1-2-6-24)22-18(21-16)25-7-9-30-10-8-25/h3-4,11-12,27H,1-2,5-10H2,(H,20,21,22,23)

InChI Key

AFQPESFQGCMCJN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00341546

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.42

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

4.290

Distribution Coefficient, logD

3.382

Water Solubility, LogSw

-4.02

Polar Surface Area

115.339

Acid Dissociation Constant (pKa)

6.55

Base Dissociation Constant (pKb)

7.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

References: we are preparing a list of scientific research reports with 8002-4818 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-4818?
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What is the minimum amount of 8002-4818 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-4818
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-4818
  • 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 8002-4818 available by request