N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline
TL;DR: N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline (CAS 137732-32-2) is a chemical compound with molecular formula C20H15N3O and molecular weight 313.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyl-2-phenylimino-1,4-benzoxazin-3-amine
Also Known As: 2,3-Dianilinoquinoxaline derivative, N-phenyl-2-phenylimino-1,4-benzoxazin-3-amine, N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline, AN-689/41741364, N2,N3-diphenyl-4H-1,4-benzoxazine-2,3-diimine
| Molecular Formula | C20H15N3O |
|---|---|
| Molecular Weight | 313.12 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 46.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.12152 |
| Heavy Atoms | 24 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 137732-32-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=NC3=CC=CC=C3OC2=NC4=CC=CC=C4 |
| InChIKey | INKCUMHTRPIKSY-UHFFFAOYSA-N |
Product Overview
N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline (CAS 137732-32-2), with molecular formula C20H15N3O and molecular weight 313.12 g/mol. IUPAC: N-phenyl-2-phenylimino-1,4-benzoxazin-3-amine.
Chemical Property Profile of N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline
Property Insights of N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline
The XLogP value of 4.5 indicates that N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.0 Ų, N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline has 1 hydrogen bond donor(s) and 3 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 N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline?
The CAS number of N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline is 137732-32-2.
What is the molecular formula of N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline?
The molecular formula of N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline is C20H15N3O.
What is the molecular weight of N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline?
The molecular weight of N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline is 313.12 g/mol.
Where can I buy N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline?
You can request a quote for N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline?
Yes, KEHONG BIO provides custom synthesis services for N-(2-(phenylimino)-2H-1,4-benzoxazin-3(4H)-ylidene)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.