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1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine
TL;DR: 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine (CAS 126420-93-7) is a chemical compound with molecular formula C21H16BrN and molecular weight 361.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-bromophenyl)methyl]-1a,9b-dihydrophenanthro[9,10-b]azirine
Also Known As: 1((4-Bromophenyl)methyl)-1a,9b-dihydro-1H-phenanthro(9,10-b)azirine, 1-[(4-bromophenyl)methyl]-1a,9b-dihydrophenanthro[9,10-b]azirine, 1-((4-Bromophenyl)methyl)-1a,9b-dihydro-1H-phenanthro(9,10-b)azirine, 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene, 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine
| Molecular Formula | C21H16BrN |
|---|---|
| Molecular Weight | 361.05 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 3.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 361.0466 |
| Heavy Atoms | 23 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 126420-93-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3C(N3CC4=CC=C(C=C4)Br)C5=CC=CC=C52 |
| InChIKey | FJWOOAVKTROJIP-UHFFFAOYSA-N |
Product Overview
1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine (CAS 126420-93-7), with molecular formula C21H16BrN and molecular weight 361.05 g/mol. IUPAC: 1-[(4-bromophenyl)methyl]-1a,9b-dihydrophenanthro[9,10-b]azirine.
Chemical Property Profile of 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine
Property Insights of 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine
The XLogP value of 5.0 indicates that 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-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, 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-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
Frequently Asked Questions
What is the CAS number of 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine?
The CAS number of 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine is 126420-93-7.
What is the molecular formula of 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine?
The molecular formula of 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine is C21H16BrN.
What is the molecular weight of 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine?
The molecular weight of 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine is 361.05 g/mol.
Where can I buy 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine?
You can request a quote for 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Bromophenyl)methyl]-1a,9b-dihydro-1H-phenanthro[9,10-b]azirine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.