(4-(Dimethylamino)phenyl)(morpholino)methanethione
TL;DR: (4-(Dimethylamino)phenyl)(morpholino)methanethione (CAS 5925-53-1) is a chemical compound with molecular formula C13H18N2OS and molecular weight 250.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(dimethylamino)phenyl]-morpholin-4-ylmethanethione
Also Known As: N,N-dimethyl-4-(morpholine-4-carbothioyl)aniline, (4-(dimethylamino)phenyl)(morpholino)methanethione, BAS 01163486, BIM-0017606.P001, J2.718.660B
| Molecular Formula | C13H18N2OS |
|---|---|
| Molecular Weight | 250.11 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 47.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.11398 |
| Heavy Atoms | 17 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 5925-53-1 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C(=S)N2CCOCC2 |
| InChIKey | VUUOTDMHABHTIG-UHFFFAOYSA-N |
Product Overview
(4-(Dimethylamino)phenyl)(morpholino)methanethione (CAS 5925-53-1), with molecular formula C13H18N2OS and molecular weight 250.11 g/mol. IUPAC: [4-(dimethylamino)phenyl]-morpholin-4-ylmethanethione.
Chemical Property Profile of (4-(Dimethylamino)phenyl)(morpholino)methanethione
Property Insights of (4-(Dimethylamino)phenyl)(morpholino)methanethione
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-(Dimethylamino)phenyl)(morpholino)methanethione. With a topological polar surface area (TPSA) of 47.8 Ų, (4-(Dimethylamino)phenyl)(morpholino)methanethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-(Dimethylamino)phenyl)(morpholino)methanethione has 0 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 (4-(Dimethylamino)phenyl)(morpholino)methanethione?
The CAS number of (4-(Dimethylamino)phenyl)(morpholino)methanethione is 5925-53-1.
What is the molecular formula of (4-(Dimethylamino)phenyl)(morpholino)methanethione?
The molecular formula of (4-(Dimethylamino)phenyl)(morpholino)methanethione is C13H18N2OS.
What is the molecular weight of (4-(Dimethylamino)phenyl)(morpholino)methanethione?
The molecular weight of (4-(Dimethylamino)phenyl)(morpholino)methanethione is 250.11 g/mol.
Where can I buy (4-(Dimethylamino)phenyl)(morpholino)methanethione?
You can request a quote for (4-(Dimethylamino)phenyl)(morpholino)methanethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-(Dimethylamino)phenyl)(morpholino)methanethione?
Yes, KEHONG BIO provides custom synthesis services for (4-(Dimethylamino)phenyl)(morpholino)methanethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.