3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide
TL;DR: 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide (CAS 452089-91-7) is a chemical compound with molecular formula C17H13BrN6O2 and molecular weight 412.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(benzotriazol-1-yl)-N-[(5-bromo-2-hydroxy-1H-indol-3-yl)imino]propanamide
Also Known As: 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide, 3-(benzotriazol-1-yl)-N'-(5-bromo-2-oxoindol-3-yl)propanehydrazide, (Z)-3-(1H-benzo[d][1,2,3]triazol-1-yl)-N'-(5-bromo-2-oxoindolin-3-ylidene)propanehydrazide, 3-(1H-1,2,3-benzotriazol-1-yl)-N'-[(3E)-5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene]propanohydrazide, 3-(1H-1,2,3-BENZOTRIAZOL-1-YL)-N'-[(3E)-5-BROMO-2-OXO-2,3-DIHYDRO-1H-INDOL-3-YLIDENE]PROPANEHYDRAZIDE
| Molecular Formula | C17H13BrN6O2 |
|---|---|
| Molecular Weight | 412.03 g/mol |
| LogP | 4.0813 |
| Topological Polar Surface Area | 108.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.02835 |
| Heavy Atoms | 26 |
| Complexity | 1146.786 |
Chemical Identifiers
| CAS Number | 452089-91-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2CCC(=O)N=NC3=C(NC4=C3C=C(C=C4)Br)O |
Product Overview
3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide (CAS 452089-91-7), with molecular formula C17H13BrN6O2 and molecular weight 412.03 g/mol. IUPAC: 3-(benzotriazol-1-yl)-N-[(5-bromo-2-hydroxy-1H-indol-3-yl)imino]propanamide.
Chemical Property Profile of 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide
Property Insights of 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide
The XLogP value of 4.0813 indicates that 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide. Following Lipinski's Rule of Five, 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide?
The CAS number of 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide is 452089-91-7.
What is the molecular formula of 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide?
The molecular formula of 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide is C17H13BrN6O2.
What is the molecular weight of 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide?
The molecular weight of 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide is 412.03 g/mol.
Where can I buy 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide?
You can request a quote for 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide?
Yes, KEHONG BIO provides custom synthesis services for 3-benzotriazol-1-yl-N'-(5-bromo-2-oxo-indol-3-yl)propanehydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.