Spirit blue base
TL;DR: Spirit blue base (CAS 22244-16-2) is a chemical compound with molecular formula C37H29N3 and molecular weight 515.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-anilinophenyl)-(4-phenyliminocyclohexa-2,5-dien-1-ylidene)methyl]-N-phenylaniline
Also Known As: Spirit blue base, Triphenyl-para-rosaniline, Benzenamine, 4,4'-((4-(phenylimino)-2,5-cyclohexadien-1-ylidene)methylene)bis(N-phenyl-, Benzenamine, 4,4'-[[4-(phenylimino)-2,5-cyclohexadien-1-ylidene]methylene]bis[N-phenyl-, 4-[(4-anilinophenyl)-(4-phenyliminocyclohexa-2,5-dien-1-ylidene)methyl]-N-phenylaniline
| Molecular Formula | C37H29N3 |
|---|---|
| Molecular Weight | 515.24 g/mol |
| LogP | 9.5 |
| Topological Polar Surface Area | 36.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 515.23615 |
| Heavy Atoms | 40 |
| Complexity | 834.0 |
Chemical Identifiers
| CAS Number | 22244-16-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=CC=C(C=C2)C(=C3C=CC(=NC4=CC=CC=C4)C=C3)C5=CC=C(C=C5)NC6=CC=CC=C6 |
| InChIKey | MIIMIZNJMPQNKO-UHFFFAOYSA-N |
Product Overview
Spirit blue base (CAS 22244-16-2), with molecular formula C37H29N3 and molecular weight 515.24 g/mol. IUPAC: 4-[(4-anilinophenyl)-(4-phenyliminocyclohexa-2,5-dien-1-ylidene)methyl]-N-phenylaniline.
Chemical Property Profile of Spirit blue base
Property Insights of Spirit blue base
The XLogP value of 9.5 indicates that Spirit blue base is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.4 Ų, Spirit blue base exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Spirit blue base has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Spirit blue base?
The CAS number of Spirit blue base is 22244-16-2.
What is the molecular formula of Spirit blue base?
The molecular formula of Spirit blue base is C37H29N3.
What is the molecular weight of Spirit blue base?
The molecular weight of Spirit blue base is 515.24 g/mol.
Where can I buy Spirit blue base?
You can request a quote for Spirit blue base directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spirit blue base?
Yes, KEHONG BIO provides custom synthesis services for Spirit blue base and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.