1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine
TL;DR: 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine (CAS 71382-45-1) is a chemical compound with molecular formula C19H15N and molecular weight 257.12045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
19-methyl-3-azapentacyclo[9.8.0.02,4.05,10.013,18]nonadeca-1(19),5,7,9,11,13,15,17-octaene
Also Known As: 7-Methylbenz(a)anthracene-5,6-imine, 7-Methylbenz(a)anthracene 5,6-imine, 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine, 7-METHYLBENZ[A]ANTHRACENE 5,6-IMINE, 1a,11b-Dihydro-11-methyl-1H-benz(3,4)anthra(1,2-b)azirine
Technical Specifications
| Molecular Formula | C19H15N |
| Molecular Weight | 257.12045 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 21.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 257.12045 Da |
| Heavy Atoms | 20 |
| Complexity | 391.0 |
| SMILES | CC1=C2C3C(N3)C4=CC=CC=C4C2=CC5=CC=CC=C15 |
| InChIKey | YWDZSKFLDHWNEP-UHFFFAOYSA-N |
Chemical Property Profile of 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine
Property Insights of 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine
The XLogP value of 3.9 indicates that 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.9 Ų, 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine has 1 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,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine?
The CAS number of 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine is 71382-45-1.
What is the molecular formula of 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine?
The molecular formula of 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine is C19H15N.
What is the molecular weight of 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine?
The molecular weight of 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine is 257.12045 g/mol.
Where can I buy 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine?
You can request a quote for 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine?
Yes, CoreyChem provides custom synthesis services for 1a,11b-Dihydro-11-methylbenz(3,4)anthra(1,2-b)azirine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.