4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate
TL;DR: 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate (CAS 443640-41-3) is a chemical compound with molecular formula C22H19NO3S and molecular weight 377.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(morpholine-4-carbothioyl)phenyl] naphthalene-2-carboxylate
Also Known As: 4-(morpholine-4-carbonothioyl)phenyl 2-naphthoate, 4-(morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate, [4-(morpholine-4-carbothioyl)phenyl] naphthalene-2-carboxylate
| Molecular Formula | C22H19NO3S |
|---|---|
| Molecular Weight | 377.11 g/mol |
| LogP | 4.0667 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 377.10855 |
| Heavy Atoms | 27 |
| Complexity | 978.2743 |
Chemical Identifiers
| CAS Number | 443640-41-3 |
|---|---|
| SMILES | C1COCCN1C(=S)C2=CC=C(C=C2)OC(=O)C3=CC4=CC=CC=C4C=C3 |
Product Overview
4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate (CAS 443640-41-3), with molecular formula C22H19NO3S and molecular weight 377.11 g/mol. IUPAC: [4-(morpholine-4-carbothioyl)phenyl] naphthalene-2-carboxylate.
Chemical Property Profile of 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate
Property Insights of 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate
The XLogP value of 4.0667 indicates that 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate has 0 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 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate?
The CAS number of 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate is 443640-41-3.
What is the molecular formula of 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate?
The molecular formula of 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate is C22H19NO3S.
What is the molecular weight of 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate?
The molecular weight of 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate is 377.11 g/mol.
Where can I buy 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate?
You can request a quote for 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-(Morpholin-4-ylcarbonothioyl)phenyl naphthalene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.