Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)-
TL;DR: Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)- (CAS 115043-27-1) is a chemical compound with molecular formula C12H15ClN2 and molecular weight 222.09238 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-4-N-cyclohexa-2,5-dien-1-ylcyclohexa-1,5-diene-1,4-diamine
Also Known As: Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)-, 4-chloro-n4-(cyclohexa-2,5-dien-1-yl)cyclohexa-1,5-diene-1,4-diamine, 4-chloro-4-N-cyclohexa-2,5-dien-1-ylcyclohexa-1,5-diene-1,4-diamine, 4-chloro-N'-(1-cyclohexa-2,5-dienyl)cyclohexa-1,5-diene-1,4-diamine, 4-Chloro-N~4~-(cyclohexa-2,5-dien-1-yl)cyclohexa-1,5-diene-1,4-diamine
Technical Specifications
| Molecular Formula | C12H15ClN2 |
| Molecular Weight | 222.09238 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 38.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.09238 Da |
| Heavy Atoms | 15 |
| Complexity | 343.0 |
| SMILES | C1C=CC(C=C1)NC2(CC=C(C=C2)N)Cl |
| InChIKey | IAHIZKCFDLPBLT-UHFFFAOYSA-N |
Chemical Property Profile of Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)-
Property Insights of Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)-. With a topological polar surface area (TPSA) of 38.1 Ų, Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)-?
The CAS number of Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)- is 115043-27-1.
What is the molecular formula of Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)-?
The molecular formula of Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)- is C12H15ClN2.
What is the molecular weight of Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)-?
The molecular weight of Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)- is 222.09238 g/mol.
Where can I buy Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)-?
You can request a quote for Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)-?
Yes, CoreyChem provides custom synthesis services for Benzenamine, 4-chloro-N-(4-imino-2,5-cyclohexadien-1-ylidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.