4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1)
TL;DR: 4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1) (CAS 3647-18-5) is a chemical compound with molecular formula C12H18ClNO2S and molecular weight 275.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-morpholin-4-yl-1-thiophen-3-ylbutan-1-one;hydrochloride
Also Known As: 5-n-Butyl-2-methylolpyridin, 4-Morpholino-1-(3-thienyl)-1-butanone hydrochloride, (Thienyl-3)(3-N-morpholinopropyl)ketone hydrochloride, 1-Butanone, 4-morpholino-1-(3-thienyl)-, hydrochloride, 4-(morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one hydrochloride(1:1)
| Molecular Formula | C12H18ClNO2S |
|---|---|
| Molecular Weight | 275.07 g/mol |
| LogP | 2.465 |
| Topological Polar Surface Area | 57.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.07468 |
| Heavy Atoms | 17 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 3647-18-5 |
|---|---|
| SMILES | C1COCCN1CCCC(=O)C2=CSC=C2.Cl |
| InChIKey | OQGITBJYKUTLHJ-UHFFFAOYSA-N |
Product Overview
4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1) (CAS 3647-18-5), with molecular formula C12H18ClNO2S and molecular weight 275.07 g/mol. IUPAC: 4-morpholin-4-yl-1-thiophen-3-ylbutan-1-one;hydrochloride.
Chemical Property Profile of 4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1)
Property Insights of 4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1)
The XLogP value of 2.465 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1). With a topological polar surface area (TPSA) of 57.8 Ų, 4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1) has 1 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-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1)?
The CAS number of 4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1) is 3647-18-5.
What is the molecular formula of 4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1)?
The molecular formula of 4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1) is C12H18ClNO2S.
What is the molecular weight of 4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1)?
The molecular weight of 4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1) is 275.07 g/mol.
Where can I buy 4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1)?
You can request a quote for 4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1) 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-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 4-(Morpholin-4-yl)-1-(thiophen-3-yl)butan-1-one--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.