RefChem:234859
TL;DR: RefChem:234859 (CAS 75449-07-9) is a chemical compound with molecular formula C12H19ClN2O2S2 and molecular weight 322.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methyl-2-methylsulfanyl-1,3-thiazol-5-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride
Also Known As: 1-(4-Methyl-2-(methylthio)-5-thiazolyl)-3-(4-morpholinyl)-1-propanone hydrochloride, 1-Propanone, 1-(4-methyl-2-(methylthio)-5-thiazolyl)-3-(4-morpholinyl)-, monohydrochloride, 1-(4-methyl-2-methylsulfanyl-1,3-thiazol-5-yl)-3-morpholin-4, 1-(4-methyl-2-methylsulfanyl-1,3-thiazol-5-yl)-3-morpholin-4-ylpropan-1-one, 1-(4-methyl-2-methylsulfanyl-1,3-thiazol-5-yl)-3-morpholin-4-ylpropan-1-one hydrochloride
| Molecular Formula | C12H19ClN2O2S2 |
|---|---|
| Molecular Weight | 322.06 g/mol |
| LogP | 2.50022 |
| Topological Polar Surface Area | 96.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.05765 |
| Heavy Atoms | 19 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 75449-07-9 |
|---|---|
| SMILES | CC1=C(SC(=N1)SC)C(=O)CCN2CCOCC2.Cl |
| InChIKey | XMVUYVHABBEELC-UHFFFAOYSA-N |
Product Overview
RefChem:234859 (CAS 75449-07-9), with molecular formula C12H19ClN2O2S2 and molecular weight 322.06 g/mol. IUPAC: 1-(4-methyl-2-methylsulfanyl-1,3-thiazol-5-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride.
Chemical Property Profile of RefChem:234859
Property Insights of RefChem:234859
The XLogP value of 2.50022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:234859. The TPSA of 96.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:234859. Following Lipinski's Rule of Five, RefChem:234859 has 1 hydrogen bond donor(s) and 6 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 RefChem:234859?
The CAS number of RefChem:234859 is 75449-07-9.
What is the molecular formula of RefChem:234859?
The molecular formula of RefChem:234859 is C12H19ClN2O2S2.
What is the molecular weight of RefChem:234859?
The molecular weight of RefChem:234859 is 322.06 g/mol.
Where can I buy RefChem:234859?
You can request a quote for RefChem:234859 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:234859?
Yes, KEHONG BIO provides custom synthesis services for RefChem:234859 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.