![3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide structure](/static/products/304/304456-46-0.png)
3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide
TL;DR: 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide (CAS 304456-46-0) is a chemical compound with molecular formula C15H17ClN2O2 and molecular weight 292.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide
Also Known As: 3-chloro-N'-(3,3-dimethyl-5-oxocyclohexylidene)benzohydrazide, 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide
| Molecular Formula | C15H17ClN2O2 |
|---|---|
| Molecular Weight | 292.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 58.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.09787 |
| Heavy Atoms | 20 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 304456-46-0 |
|---|---|
| SMILES | CC1(CC(=NNC(=O)C2=CC(=CC=C2)Cl)CC(=O)C1)C |
| InChIKey | LXEOSJQIAMIMDH-UHFFFAOYSA-N |
Product Overview
3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide (CAS 304456-46-0), with molecular formula C15H17ClN2O2 and molecular weight 292.10 g/mol. IUPAC: 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide.
Chemical Property Profile of 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide
Property Insights of 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide. With a topological polar surface area (TPSA) of 58.5 Ų, 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide has 1 hydrogen bond donor(s) and 3 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-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide?
The CAS number of 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide is 304456-46-0.
What is the molecular formula of 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide?
The molecular formula of 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide is C15H17ClN2O2.
What is the molecular weight of 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide?
The molecular weight of 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide is 292.10 g/mol.
Where can I buy 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide?
You can request a quote for 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-[(3,3-dimethyl-5-oxocyclohexylidene)amino]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.