1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine
TL;DR: 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine (CAS 126420-94-8) is a chemical compound with molecular formula C22H19N and molecular weight 297.15176 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(4-methylphenyl)methyl]-1a,9b-dihydrophenanthro[9,10-b]azirine
Also Known As: 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine, 1H-Phenanthro[9,10-b]azirine, 1a,9b-dihydro-1-[(4-methylphenyl)methyl]-, 1-[(4-methylphenyl)methyl]-1a,9b-dihydrophenanthro[9,10-b]azirine, 1-[(4-Methylphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene, 1-[(4-Methylphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine
Technical Specifications
| Molecular Formula | C22H19N |
| Molecular Weight | 297.15176 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 3.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 297.15176 Da |
| Heavy Atoms | 23 |
| Complexity | 396.0 |
| SMILES | CC1=CC=C(C=C1)CN2C3C2C4=CC=CC=C4C5=CC=CC=C35 |
| InChIKey | NTQYGHHSHQTSRR-UHFFFAOYSA-N |
Chemical Property Profile of 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine
Property Insights of 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine
The XLogP value of 4.7 indicates that 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.0 Ų, 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine?
The CAS number of 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine is 126420-94-8.
What is the molecular formula of 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine?
The molecular formula of 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine is C22H19N.
What is the molecular weight of 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine?
The molecular weight of 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine is 297.15176 g/mol.
Where can I buy 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine?
You can request a quote for 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine?
Yes, CoreyChem provides custom synthesis services for 1a,9b-Dihydro-1-((4-methylphenyl)methyl)-1H-phenanthro(9,10-b)azirine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.