4512-2256 Screening compound: 2-(1H-1,2,3-benzotriazol-1-yl)-N'-[(E)-{2-[(4-chlorophenyl)methoxy]phenyl}methylidene]propanehydrazide

4512-2256 Screening compound: 2-(1H-1,2,3-benzotriazol-1-yl)-N'-[(E)-{2-[(4-chlorophenyl)methoxy]phenyl}methylidene]propanehydrazide
4512-2256 Screening compound: 2-(1H-1,2,3-benzotriazol-1-yl)-N'-[(E)-{2-[(4-chlorophenyl)methoxy]phenyl}methylidene]propanehydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4512-2256
2-(1H-1,2,3-benzotriazol-1-yl)-N'-[(E)-{2-[(4-chlorophenyl)methoxy]phenyl}methylidene]propanehydrazide

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

4512-2256

Molecular Formula

C23H20ClN5O2 (C23 H20 ClN5 O2)

Compound Name

2-(1H-1,2,3-benzotriazol-1-yl)-N'-[(E)-{2-[(4-chlorophenyl)methoxy]phenyl}methylidene]propanehydrazide

IUPAC name

2-(1H-123-benzotriazol-1-yl)-N'-[(E)-{2-[(4-chlorophenyl)methoxy]phenyl}methylidene]propanehydrazide

SMILES

CC(C(N/N=C/c(cccc1)c1OCc(cc1)ccc1Cl)=O)n1nnc2c1cccc2

InChI

InChI=1S/C23H20ClN5O2/c1-16(29-21-8-4-3-7-20(21)26-28-29)23(30)27-25-14-18-6-2-5-9-22(18)31-15-17-10-12-19(24)13-11-17/h2-14,16H,15H2,1H3,(H,27,30)/t16-/m0/s1

InChI Key

VNNLWJGATJLDQE-INIZCTEOSA-N

MDL Number (MFCD)

MFCD02611103

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.9

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.108

Distribution Coefficient, logD

5.108

Water Solubility, LogSw

-5.43

Polar Surface Area

68.655

Acid Dissociation Constant (pKa)

10.91

Base Dissociation Constant (pKb)

1.51

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.00

References: we are preparing a list of scientific research reports with 4512-2256 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4512-2256?
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What is the minimum amount of 4512-2256 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4512-2256
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4512-2256
  • 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 4512-2256 available by request