N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide
TL;DR: N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide (CAS 308294-00-0) is a chemical compound with molecular formula C13H16N2O2S and molecular weight 264.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(Z)-(3,3-dimethyl-5-oxocyclohexylidene)amino]thiophene-2-carboxamide
Also Known As: N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide, AN-329/40529433, N'-[(1Z)-3,3-dimethyl-5-oxocyclohexylidene]thiophene-2-carbohydrazide, N'-[(1Z)-3,3-Dimethyl-5-oxocyclohexylidene]-2-thiophenecarbohydrazide #, N-[(Z)-(3,3-dimethyl-5-oxocyclohexylidene)amino]thiophene-2-carboxamide
| Molecular Formula | C13H16N2O2S |
|---|---|
| Molecular Weight | 264.09 g/mol |
| LogP | 2.6131 |
| Topological Polar Surface Area | 58.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.09326 |
| Heavy Atoms | 18 |
| Complexity | 489.09933 |
Chemical Identifiers
| CAS Number | 308294-00-0 |
|---|---|
| SMILES | CC1(C/C(=N/NC(=O)C2=CC=CS2)/CC(=O)C1)C |
Product Overview
N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide (CAS 308294-00-0), with molecular formula C13H16N2O2S and molecular weight 264.09 g/mol. IUPAC: N-[(Z)-(3,3-dimethyl-5-oxocyclohexylidene)amino]thiophene-2-carboxamide.
Chemical Property Profile of N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide
Property Insights of N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide
The XLogP value of 2.6131 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide. With a topological polar surface area (TPSA) of 58.53 Ų, N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide 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 N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide?
The CAS number of N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide is 308294-00-0.
What is the molecular formula of N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide?
The molecular formula of N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide is C13H16N2O2S.
What is the molecular weight of N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide?
The molecular weight of N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide is 264.09 g/mol.
Where can I buy N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide?
You can request a quote for N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'-(3,3-dimethyl-5-oxocyclohexylidene)-2-thiophenecarbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.