xanthocillin X monomethyl ether
TL;DR: xanthocillin X monomethyl ether (CAS 19559-24-1) is a chemical compound with molecular formula C19H14N2O2 and molecular weight 302.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(1Z,3Z)-2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]phenol
Also Known As: Xanthocillin X monomethyl ether, Xanthocillin-X monomethylether, 4-[(1Z,3Z)-2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]phenol, Phenol, 4-(2,3-diisocyano-4-(4-methoxyphenyl)-1,3-butadienyl)-, Ethylene isocyanide, (p-hydroxybenzylidene)(p-methoxybenzylidine)-
| Molecular Formula | C19H14N2O2 |
|---|---|
| Molecular Weight | 302.11 g/mol |
| LogP | 4.62138 |
| Topological Polar Surface Area | 38.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.10553 |
| Heavy Atoms | 23 |
| Complexity | 817.6587 |
Chemical Identifiers
| CAS Number | 19559-24-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C(/C(=C/C2=CC=C(C=C2)O)/[N+]#[C-])\[N+]#[C-] |
Product Overview
xanthocillin X monomethyl ether (CAS 19559-24-1), with molecular formula C19H14N2O2 and molecular weight 302.11 g/mol. IUPAC: 4-[(1Z,3Z)-2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]phenol.
Chemical Property Profile of xanthocillin X monomethyl ether
Property Insights of xanthocillin X monomethyl ether
The XLogP value of 4.62138 indicates that xanthocillin X monomethyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.18 Ų, xanthocillin X monomethyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, xanthocillin X monomethyl ether has 1 hydrogen bond donor(s) and 2 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 xanthocillin X monomethyl ether?
The CAS number of xanthocillin X monomethyl ether is 19559-24-1.
What is the molecular formula of xanthocillin X monomethyl ether?
The molecular formula of xanthocillin X monomethyl ether is C19H14N2O2.
What is the molecular weight of xanthocillin X monomethyl ether?
The molecular weight of xanthocillin X monomethyl ether is 302.11 g/mol.
Where can I buy xanthocillin X monomethyl ether?
You can request a quote for xanthocillin X monomethyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for xanthocillin X monomethyl ether?
Yes, KEHONG BIO provides custom synthesis services for xanthocillin X monomethyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.