对硝基苯甲酸环己亚基酰肼
TL;DR: 对硝基苯甲酸环己亚基酰肼 (CAS 329-84-0) is a chemical compound with molecular formula C13H15N3O3 and molecular weight 261.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
对硝基苯甲酸环己亚基酰肼
N-(cyclohexylideneamino)-4-nitrobenzamide
Also Known As: N-(cyclohexylideneamino)-4-nitrobenzamide, N'-cyclohexylidene-4-nitrobenzohydrazide, p-Nitrobenzoic acid cyclohexylidene hydrazide, BENZOIC ACID, p-NITRO-, CYCLOHEXYLIDENEHYDRAZIDE, Benzoic acid, 4-nitro-, cyclohexylidenehydrazide
| Molecular Formula | C13H15N3O3 |
|---|---|
| Molecular Weight | 261.11 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 87.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.11133 |
| Heavy Atoms | 19 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 329-84-0 |
|---|---|
| SMILES | C1CCC(=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])CC1 |
| InChIKey | KJWVNIDYPSXHBP-UHFFFAOYSA-N |
Product Overview
对硝基苯甲酸环己亚基酰肼 (CAS 329-84-0), with molecular formula C13H15N3O3 and molecular weight 261.11 g/mol. IUPAC: N-(cyclohexylideneamino)-4-nitrobenzamide.
Chemical Property Profile of 对硝基苯甲酸环己亚基酰肼
Property Insights of 对硝基苯甲酸环己亚基酰肼
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 对硝基苯甲酸环己亚基酰肼. The TPSA of 87.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 对硝基苯甲酸环己亚基酰肼. Following Lipinski's Rule of Five, 对硝基苯甲酸环己亚基酰肼 has 1 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 对硝基苯甲酸环己亚基酰肼?
The CAS number of 对硝基苯甲酸环己亚基酰肼 is 329-84-0.
What is the molecular formula of 对硝基苯甲酸环己亚基酰肼?
The molecular formula of 对硝基苯甲酸环己亚基酰肼 is C13H15N3O3.
What is the molecular weight of 对硝基苯甲酸环己亚基酰肼?
The molecular weight of 对硝基苯甲酸环己亚基酰肼 is 261.11 g/mol.
Where can I buy 对硝基苯甲酸环己亚基酰肼?
You can request a quote for 对硝基苯甲酸环己亚基酰肼 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 对硝基苯甲酸环己亚基酰肼?
Yes, KEHONG BIO provides custom synthesis services for 对硝基苯甲酸环己亚基酰肼 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.