N-(3-Methoxyphenyl)-4-morpholinecarbothioamide
TL;DR: N-(3-Methoxyphenyl)-4-morpholinecarbothioamide (CAS 300706-28-9) is a chemical compound with molecular formula C12H16N2O2S and molecular weight 252.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methoxyphenyl)morpholine-4-carbothioamide
Also Known As: Maybridge1_003646, N-(3-methoxyphenyl)morpholine-4-carbothioamide, N-(3-Methoxyphenyl)-4-morpholinecarbothioamide, AB00040596-01, AB00040596-02
| Molecular Formula | C12H16N2O2S |
|---|---|
| Molecular Weight | 252.09 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 65.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.09325 |
| Heavy Atoms | 17 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 300706-28-9 |
|---|---|
| SMILES | COC1=CC=CC(=C1)NC(=S)N2CCOCC2 |
| InChIKey | CEJQDZXDKAVQPG-UHFFFAOYSA-N |
Product Overview
N-(3-Methoxyphenyl)-4-morpholinecarbothioamide (CAS 300706-28-9), with molecular formula C12H16N2O2S and molecular weight 252.09 g/mol. IUPAC: N-(3-methoxyphenyl)morpholine-4-carbothioamide.
Chemical Property Profile of N-(3-Methoxyphenyl)-4-morpholinecarbothioamide
Property Insights of N-(3-Methoxyphenyl)-4-morpholinecarbothioamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-Methoxyphenyl)-4-morpholinecarbothioamide. The TPSA of 65.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-Methoxyphenyl)-4-morpholinecarbothioamide. Following Lipinski's Rule of Five, N-(3-Methoxyphenyl)-4-morpholinecarbothioamide has 1 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-(3-Methoxyphenyl)-4-morpholinecarbothioamide?
The CAS number of N-(3-Methoxyphenyl)-4-morpholinecarbothioamide is 300706-28-9.
What is the molecular formula of N-(3-Methoxyphenyl)-4-morpholinecarbothioamide?
The molecular formula of N-(3-Methoxyphenyl)-4-morpholinecarbothioamide is C12H16N2O2S.
What is the molecular weight of N-(3-Methoxyphenyl)-4-morpholinecarbothioamide?
The molecular weight of N-(3-Methoxyphenyl)-4-morpholinecarbothioamide is 252.09 g/mol.
Where can I buy N-(3-Methoxyphenyl)-4-morpholinecarbothioamide?
You can request a quote for N-(3-Methoxyphenyl)-4-morpholinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-Methoxyphenyl)-4-morpholinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-Methoxyphenyl)-4-morpholinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.