2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol
TL;DR: 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol (CAS 869943-08-8) is a chemical compound with molecular formula C10H17NOS and molecular weight 199.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-methylthiophen-2-yl)methylamino]butan-1-ol
Also Known As: 2-{[(5-methyl-2-thienyl)methyl]amino}-1-butanol, 3,4-Diethoxy-benzylamine, 2-[(5-methylthiophen-2-yl)methylamino]butan-1-ol, 2-{[(5-methylthiophen-2-yl)methyl]amino}butan-1-ol, 2-{[(5-Methyl-2-thienyl)methyl]amino}
| Molecular Formula | C10H17NOS |
|---|---|
| Molecular Weight | 199.10 g/mol |
| LogP | 1.91702 |
| Topological Polar Surface Area | 32.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 199.10309 |
| Heavy Atoms | 13 |
| Complexity | 242.82771 |
Chemical Identifiers
| CAS Number | 869943-08-8 |
|---|---|
| SMILES | CCC(CO)NCC1=CC=C(S1)C |
Product Overview
2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol (CAS 869943-08-8), with molecular formula C10H17NOS and molecular weight 199.10 g/mol. IUPAC: 2-[(5-methylthiophen-2-yl)methylamino]butan-1-ol.
Chemical Property Profile of 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol
Property Insights of 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol
The XLogP value of 1.91702 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol. With a topological polar surface area (TPSA) of 32.26 Ų, 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol 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 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol?
The CAS number of 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol is 869943-08-8.
What is the molecular formula of 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol?
The molecular formula of 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol is C10H17NOS.
What is the molecular weight of 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol?
The molecular weight of 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol is 199.10 g/mol.
Where can I buy 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol?
You can request a quote for 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(5-Methyl-2-thienyl)methyl]amino}-1-butanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.