1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl-
TL;DR: 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl- (CAS 64188-96-1) is a chemical compound with molecular formula C21H17N and molecular weight 283.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-1a,9b-dihydrophenanthro[9,10-b]azirine
Also Known As: N-Benzylphenanthrene-9,10-imine, N-(Phenylmethyl)phenanthrene 9,10-imine, 1H-pyrido[3,4-d]triazin-4-one, N-cyclohexyl-2H-phenanthren-1-imine, 1a,9b-Dihydro-1-(phenylmethyl)-1H-phenanthro(9,10-b)azirine
| Molecular Formula | C21H17N |
|---|---|
| Molecular Weight | 283.14 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 3.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.1361 |
| Heavy Atoms | 22 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 64188-96-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C3C2C4=CC=CC=C4C5=CC=CC=C35 |
| InChIKey | LZJAUXDGBHATJG-UHFFFAOYSA-N |
Product Overview
1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl- (CAS 64188-96-1), with molecular formula C21H17N and molecular weight 283.14 g/mol. IUPAC: 1-benzyl-1a,9b-dihydrophenanthro[9,10-b]azirine.
Chemical Property Profile of 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl-
Property Insights of 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl-
The XLogP value of 4.3 indicates that 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.0 Ų, 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl- 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 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl-?
The CAS number of 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl- is 64188-96-1.
What is the molecular formula of 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl-?
The molecular formula of 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl- is C21H17N.
What is the molecular weight of 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl-?
The molecular weight of 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl- is 283.14 g/mol.
Where can I buy 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl-?
You can request a quote for 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Phenanthro(9,10-b)azirine, 1a,9b-dihydro-1-benzyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.