3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide
TL;DR: 3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide (CAS 612047-71-9) is a chemical compound with molecular formula C17H14N6O2 and molecular weight 334.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(benzotriazol-1-yl)-N-[(2-hydroxy-1H-indol-3-yl)imino]propanamide
Also Known As: 3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide, 3-(1H-benzotriazol-1-yl)-N'-[(3E)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]propanehydrazide, (Z)-3-(1H-benzo[d][1,2,3]triazol-1-yl)-N'-(2-oxoindolin-3-ylidene)propanehydrazide, 3-(1H-1,2,3-BENZOTRIAZOL-1-YL)-N'-[(3E)-2-OXO-2,3-DIHYDRO-1H-INDOL-3-YLIDENE]PROPANEHYDRAZIDE
| Molecular Formula | C17H14N6O2 |
|---|---|
| Molecular Weight | 334.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 334.11783 |
| Heavy Atoms | 25 |
| Complexity | 515.0 |
Chemical Identifiers
| CAS Number | 612047-71-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(N2)O)N=NC(=O)CCN3C4=CC=CC=C4N=N3 |
| InChIKey | ITDWMCDRNJKCEG-UHFFFAOYSA-N |
Product Overview
3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide (CAS 612047-71-9), with molecular formula C17H14N6O2 and molecular weight 334.12 g/mol. IUPAC: 3-(benzotriazol-1-yl)-N-[(2-hydroxy-1H-indol-3-yl)imino]propanamide.
Chemical Property Profile of 3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide
Property Insights of 3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide. Following Lipinski's Rule of Five, 3-(benzotriazol-1-yl)-N'-(2-oxoindol-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'-(2-oxoindol-3-yl)propanehydrazide?
The CAS number of 3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide is 612047-71-9.
What is the molecular formula of 3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide?
The molecular formula of 3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide is C17H14N6O2.
What is the molecular weight of 3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide?
The molecular weight of 3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide is 334.12 g/mol.
Where can I buy 3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide?
You can request a quote for 3-(benzotriazol-1-yl)-N'-(2-oxoindol-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'-(2-oxoindol-3-yl)propanehydrazide?
Yes, KEHONG BIO provides custom synthesis services for 3-(benzotriazol-1-yl)-N'-(2-oxoindol-3-yl)propanehydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.