![4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine structure](/static/products/5785/57855-51-3.webp)
4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine
TL;DR: 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine (CAS 57855-51-3) is a chemical compound with molecular formula C19H16N2 and molecular weight 272.13135 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(4-iminocyclohexa-2,5-dien-1-ylidene)-phenylmethyl]aniline
Also Known As: NCIStruc1_001048, NCIStruc2_001089, YTC2-F_000904, YTC2.1-F_000075, YTC2.1-F_001041
Technical Specifications
| Molecular Formula | C19H16N2 |
| Molecular Weight | 272.13135 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 49.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.13135 Da |
| Heavy Atoms | 21 |
| Complexity | 452.0 |
| SMILES | C1=CC=C(C=C1)C(=C2C=CC(=N)C=C2)C3=CC=C(C=C3)N |
| InChIKey | PMYHWVXMXZGMBL-UHFFFAOYSA-N |
Chemical Property Profile of 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine
Property Insights of 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine
The XLogP value of 4.0 indicates that 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.9 Ų, 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine 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 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine?
The CAS number of 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine is 57855-51-3.
What is the molecular formula of 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine?
The molecular formula of 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine is C19H16N2.
What is the molecular weight of 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine?
The molecular weight of 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine is 272.13135 g/mol.
Where can I buy 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine?
You can request a quote for 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine?
Yes, CoreyChem provides custom synthesis services for 4-[(4-Imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]benzenamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.