3229-2899 Screening compound: 2-[(E)-{2-[4,6-bis(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-4-[(1Z)-2-[3-(trifluoromethyl)phenyl]diazen-1-yl]phenol

3229-2899 Screening compound: 2-[(E)-{2-[4,6-bis(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-4-[(1Z)-2-[3-(trifluoromethyl)phenyl]diazen-1-yl]phenol
3229-2899 Screening compound: 2-[(E)-{2-[4,6-bis(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-4-[(1Z)-2-[3-(trifluoromethyl)phenyl]diazen-1-yl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 3229-2899
2-[(E)-{2-[4,6-bis(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-4-[(1Z)-2-[3-(trifluoromethyl)phenyl]diazen-1-yl]phenol

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

3229-2899

Molecular Formula

C25H26F3N9O (C25 H26 F3 N9 O)

Compound Name

2-[(E)-{2-[4,6-bis(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-4-[(1Z)-2-[3-(trifluoromethyl)phenyl]diazen-1-yl]phenol

IUPAC name

2-[(E)-{2-[46-bis(pyrrolidin-1-yl)-135-triazin-2-yl]hydrazin-1-ylidene}methyl]-4-[(1Z)-2-[3-(trifluoromethyl)phenyl]diazen-1-yl]phenol

SMILES

Oc(cc1)c(/C=N/Nc2nc(N3CCCC3)nc(N3CCCC3)n2)cc1/N=N\c1cccc(C(F)(F)F)c1

InChI

InChI=1S/C25H26F3N9O/c26-25(27,28)18-6-5-7-19(15-18)33-34-20-8-9-21(38)17(14-20)16-29-35-22-30-23(36-10-1-2-11-36)32-24(31-22)37-12-3-4-13-37/h5-9,14-16,38H,1-4,10-13H2,(H,30,31,32,35)

InChI Key

TUVHWKHGDPSRHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02109051

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

525.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

7.947

Distribution Coefficient, logD

7.920

Water Solubility, LogSw

-6.12

Polar Surface Area

96.102

Acid Dissociation Constant (pKa)

9.50

Base Dissociation Constant (pKb)

7.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

References: we are preparing a list of scientific research reports with 3229-2899 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3229-2899?
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What is the minimum amount of 3229-2899 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3229-2899
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3229-2899
  • 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 3229-2899 available by request