RefChem:888780
TL;DR: RefChem:888780 (CAS 55250-84-5) is a chemical compound with molecular formula C34H32N2O3 and molecular weight 516.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2'-anilino-6'-[cyclohexyl(methyl)amino]-3'-methylspiro[2-benzofuran-3,9'-xanthene]-1-one
Also Known As: 3-(N-Cyclohexyl-N-methyl)amino-6-methyl-7-anilinofluoran, 3-(N-Cyclohexyl-N-methylamino)-6-methyl-7-anilinofluoran, Spiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one, 6'-(cyclohexylmethylamino)-3'-methyl-2'-(phenylamino)-, 2-Anilino-6-(N-cyclohexyl-N-methylamino)-3-methylfluoran, 2-Anilino-3-methyl-6-(N-cyclohexyl-N-methylamino)fluoran
| Molecular Formula | C34H32N2O3 |
|---|---|
| Molecular Weight | 516.24 g/mol |
| LogP | 8.0 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 516.2413 |
| Heavy Atoms | 39 |
| Complexity | 869.0 |
Chemical Identifiers
| CAS Number | 55250-84-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1NC3=CC=CC=C3)C4(C5=C(O2)C=C(C=C5)N(C)C6CCCCC6)C7=CC=CC=C7C(=O)O4 |
| InChIKey | CEGHCPGGKKWOKF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:888780 (CAS 55250-84-5), with molecular formula C34H32N2O3 and molecular weight 516.24 g/mol. IUPAC: 2'-anilino-6'-[cyclohexyl(methyl)amino]-3'-methylspiro[2-benzofuran-3,9'-xanthene]-1-one.
Chemical Property Profile of RefChem:888780
Property Insights of RefChem:888780
The XLogP value of 8.0 indicates that RefChem:888780 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.8 Ų, RefChem:888780 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:888780 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:888780?
The CAS number of RefChem:888780 is 55250-84-5.
What is the molecular formula of RefChem:888780?
The molecular formula of RefChem:888780 is C34H32N2O3.
What is the molecular weight of RefChem:888780?
The molecular weight of RefChem:888780 is 516.24 g/mol.
Where can I buy RefChem:888780?
You can request a quote for RefChem:888780 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:888780?
Yes, KEHONG BIO provides custom synthesis services for RefChem:888780 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.