[4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate
TL;DR: [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate (CAS 14297-28-0) is a chemical compound with molecular formula C18H14ClF2N7O4 and molecular weight 465.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate
Also Known As: [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate|[4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxy-phenyl] 2-chloro-4,5-difluoro-benzoate|N-({4-[(2-Chloro-4,5-difluorobenzoyl)oxy]-3-methoxyphenyl}methylidene)(5-imino-2,5-dihydro-1H-tetrazol-1-yl)ethanehydrazonic acid|N-({4-[(2-Chloro-4,5-difluorobenzoyl)oxy]-3-methoxyphenyl}methylidene)-2-(5-imino-2,5-dihydro-1H-tetrazol-1-yl)ethanehydrazonic acid
| Molecular Formula | C18H14ClF2N7O4 |
|---|---|
| Molecular Weight | 465.08 g/mol |
| LogP | 1.565 |
| Topological Polar Surface Area | 146.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 465.0764 |
| Heavy Atoms | 32 |
| Complexity | 1202.0664 |
Chemical Identifiers
| CAS Number | 14297-28-0 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C=NNC(=O)CN2C(=NN=N2)N)OC(=O)C3=CC(=C(C=C3Cl)F)F |
Product Overview
[4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate (CAS 14297-28-0), with molecular formula C18H14ClF2N7O4 and molecular weight 465.08 g/mol. IUPAC: [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate.
Chemical Property Profile of [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate
Property Insights of [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate
The XLogP value of 1.565 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate. The TPSA of 146.61 Ų indicates high polarity, suggesting [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate has 2 hydrogen bond donor(s) and 9 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 [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate?
The CAS number of [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate is 14297-28-0.
What is the molecular formula of [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate?
The molecular formula of [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate is C18H14ClF2N7O4.
What is the molecular weight of [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate?
The molecular weight of [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate is 465.08 g/mol.
Where can I buy [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate?
You can request a quote for [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [4-[[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2-chloro-4,5-difluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.