1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene
TL;DR: 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene (CAS 126370-98-7) is a chemical compound with molecular formula C22H19NO and molecular weight 313.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3-methoxyphenyl)methyl]-1a,9b-dihydrophenanthro[9,10-b]azirine
Also Known As: 1a,9b-Dihydro-1-((3-methoxyphenyl)methyl)-1H-phenanthro(9,10-b)azirine, 1-[(3-methoxyphenyl)methyl]-1a,9b-dihydrophenanthro[9,10-b]azirine, 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene, 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine
| Molecular Formula | C22H19NO |
|---|---|
| Molecular Weight | 313.15 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 12.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.14667 |
| Heavy Atoms | 24 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 126370-98-7 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CN2C3C2C4=CC=CC=C4C5=CC=CC=C35 |
| InChIKey | CPYLCHDPRMGPEE-UHFFFAOYSA-N |
Product Overview
1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene (CAS 126370-98-7), with molecular formula C22H19NO and molecular weight 313.15 g/mol. IUPAC: 1-[(3-methoxyphenyl)methyl]-1a,9b-dihydrophenanthro[9,10-b]azirine.
Chemical Property Profile of 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene
Property Insights of 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene
The XLogP value of 4.3 indicates that 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.2 Ų, 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene has 0 hydrogen bond donor(s) and 2 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 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene?
The CAS number of 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene is 126370-98-7.
What is the molecular formula of 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene?
The molecular formula of 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene is C22H19NO.
What is the molecular weight of 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene?
The molecular weight of 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene is 313.15 g/mol.
Where can I buy 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene?
You can request a quote for 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene?
Yes, KEHONG BIO provides custom synthesis services for 1-[(3-Methoxyphenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.