Crinasiatine
TL;DR: Crinasiatine (CAS 97682-69-4) is a chemical compound with molecular formula C22H17NO4 and molecular weight 359.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[(4-hydroxyphenyl)methyl]-9,10-dihydro-5H-[1,4]dioxino[2,3-j]phenanthridin-6-one
Also Known As: Crinasiatine, J2.770.469G, 9-[(4-hydroxyphenyl)methyl]-9,10-dihydro-5H-[1,4]dioxino[2,3-j]phenanthridin-6-one, (1,4)Dioxino(2,3-j)phenanthridin-6(5H)-one, 9,10-dihydro-9-((4-hydroxyphenyl)methyl)-, 3-[(4-hydroxyphenyl)methyl]-2,3,6,7-tetrahydro-1,4-dioxa-7-azatetraphen-6-one
| Molecular Formula | C22H17NO4 |
|---|---|
| Molecular Weight | 359.12 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 359.11575 |
| Heavy Atoms | 27 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 97682-69-4 |
|---|---|
| SMILES | C1C(OC2=C(O1)C=C3C4=CC=CC=C4NC(=O)C3=C2)CC5=CC=C(C=C5)O |
| InChIKey | XFYYJHYSDXQMAE-UHFFFAOYSA-N |
Product Overview
Crinasiatine (CAS 97682-69-4), with molecular formula C22H17NO4 and molecular weight 359.12 g/mol. IUPAC: 9-[(4-hydroxyphenyl)methyl]-9,10-dihydro-5H-[1,4]dioxino[2,3-j]phenanthridin-6-one.
Chemical Property Profile of Crinasiatine
Property Insights of Crinasiatine
The XLogP value of 3.8 indicates that Crinasiatine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Crinasiatine. Following Lipinski's Rule of Five, Crinasiatine has 2 hydrogen bond donor(s) and 4 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 Crinasiatine?
The CAS number of Crinasiatine is 97682-69-4.
What is the molecular formula of Crinasiatine?
The molecular formula of Crinasiatine is C22H17NO4.
What is the molecular weight of Crinasiatine?
The molecular weight of Crinasiatine is 359.12 g/mol.
Where can I buy Crinasiatine?
You can request a quote for Crinasiatine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Crinasiatine?
Yes, KEHONG BIO provides custom synthesis services for Crinasiatine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.