![N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide structure](/static/products/5164/516457-67-3.webp)
N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide
TL;DR: N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide (CAS 516457-67-3) is a chemical compound with molecular formula C17H19N3OS and molecular weight 313.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-anilinophenyl)morpholine-4-carbothioamide
Also Known As: N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide, N-(4-anilinophenyl)morpholine-4-carbothioamide, N-(4-(phenylamino)phenyl)morpholine-4-carbothioamide, N-(4-ANILINOPHENYL)-4-MORPHOLINECARBOTHIOAMIDE, morpholin-4-yl{[4-(phenylamino)phenyl]amino}methane-1-thione
| Molecular Formula | C17H19N3OS |
|---|---|
| Molecular Weight | 313.12 g/mol |
| LogP | 3.4592 |
| Topological Polar Surface Area | 36.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.12488 |
| Heavy Atoms | 22 |
| Complexity | 609.561 |
Chemical Identifiers
| CAS Number | 516457-67-3 |
|---|---|
| SMILES | C1COCCN1C(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3 |
Product Overview
N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide (CAS 516457-67-3), with molecular formula C17H19N3OS and molecular weight 313.12 g/mol. IUPAC: N-(4-anilinophenyl)morpholine-4-carbothioamide.
Chemical Property Profile of N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide
Property Insights of N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide
The XLogP value of 3.4592 indicates that N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.53 Ų, N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide has 2 hydrogen bond donor(s) and 3 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 N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide?
The CAS number of N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide is 516457-67-3.
What is the molecular formula of N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide?
The molecular formula of N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide is C17H19N3OS.
What is the molecular weight of N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide?
The molecular weight of N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide is 313.12 g/mol.
Where can I buy N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide?
You can request a quote for N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(phenylamino)phenyl]morpholine-4-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.