8005-6137 Screening compound: 4-({(E)-2-[(1,5-diphenyl-1H-1,2,4-triazol-3-yl)carbonyl]hydrazono}methyl)benzoic acid
Chemical Structure Depiction of ChemDiv screening compound 8005-6137
4-({(E)-2-[(1,5-diphenyl-1H-1,2,4-triazol-3-yl)carbonyl]hydrazono}methyl)benzoic acid
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
8005-6137
Molecular Formula
C23H17N5O3 (C23 H17 N5 O3)
Compound Name
4-({(E)-2-[(1,5-diphenyl-1H-1,2,4-triazol-3-yl)carbonyl]hydrazono}methyl)benzoic acid
IUPAC name
4-[(E)-{[(15-diphenyl-1H-124-triazol-3-yl)formamido]imino}methyl]benzoic acid
SMILES
OC(c1ccc(/C=N/NC(c(nc2-c3ccccc3)nn2-c2ccccc2)=O)cc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
411.42
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
4.387
Distribution Coefficient, logD
0.780
Water Solubility, LogSw
-4.43
Polar Surface Area
87.613
Acid Dissociation Constant (pKa)
3.79
Base Dissociation Constant (pKb)
-0.31
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
0.00
References: we are preparing a list of scientific research reports with 8005-6137 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)