Benzhydrazone
TL;DR: Benzhydrazone (CAS 76790-71-1) is a chemical compound with molecular formula C15H16N8 and molecular weight 308.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(Z)-[(3Z)-3-(diaminomethylidenehydrazinylidene)cyclopenta[b]naphthalen-1-ylidene]amino]guanidine
Also Known As: Benzhydrazone, S-Heptan-2-yl ethanethioate, 1H-Benz(f)indene-1,3(2H)dione-bis-amidinohydrazone, Hydrazinecarboximidamide, 2,2'-(1H-benz(f)indene-1,3(2H)-diylidene)bis-, dihydrochloride, 2-[(Z)-[(3Z)-3-(diaminomethylidenehydrazinylidene)cyclopenta[b]naphthalen-1-ylidene]amino]guanidine
| Molecular Formula | C15H16N8 |
|---|---|
| Molecular Weight | 308.15 g/mol |
| LogP | 0.1985 |
| Topological Polar Surface Area | 153.52 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 308.14978 |
| Heavy Atoms | 23 |
| Complexity | 810.98505 |
Chemical Identifiers
| CAS Number | 76790-71-1 |
|---|---|
| SMILES | C\1/C(=N/N=C(N)N)/C2=CC3=CC=CC=C3C=C2/C1=N\N=C(N)N |
Product Overview
Benzhydrazone (CAS 76790-71-1), with molecular formula C15H16N8 and molecular weight 308.15 g/mol. IUPAC: 2-[(Z)-[(3Z)-3-(diaminomethylidenehydrazinylidene)cyclopenta[b]naphthalen-1-ylidene]amino]guanidine.
Chemical Property Profile of Benzhydrazone
Property Insights of Benzhydrazone
The XLogP value of 0.1985 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzhydrazone. The TPSA of 153.52 Ų indicates high polarity, suggesting Benzhydrazone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzhydrazone has 4 hydrogen bond donor(s) and 4 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 Benzhydrazone?
The CAS number of Benzhydrazone is 76790-71-1.
What is the molecular formula of Benzhydrazone?
The molecular formula of Benzhydrazone is C15H16N8.
What is the molecular weight of Benzhydrazone?
The molecular weight of Benzhydrazone is 308.15 g/mol.
Where can I buy Benzhydrazone?
You can request a quote for Benzhydrazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzhydrazone?
Yes, KEHONG BIO provides custom synthesis services for Benzhydrazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.