![2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride structure](/static/products/185/185380-87-4.png)
2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride
TL;DR: 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride (CAS 185380-87-4) is a chemical compound with molecular formula C12H23ClN2OS and molecular weight 278.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methyl-8-pentyl-5,6,7,8a-tetrahydro-[1,3]thiazolo[3,2-a]pyrazin-3-one;hydrochloride
Also Known As: BIM-0014644.P001, 2-methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride, 8-methyl-8-pentyl-5,6,7,8a-tetrahydro-[1,3]thiazolo[3,2-a]pyrazin-3-one hydrochloride, 8-methyl-8-pentyltetrahydro-2H-thiazolo[3,2-a]pyrazin-3(5H)-one hydrochloride
| Molecular Formula | C12H23ClN2OS |
|---|---|
| Molecular Weight | 278.12 g/mol |
| LogP | 2.2519 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.12195 |
| Heavy Atoms | 17 |
| Complexity | 277.23123 |
Chemical Identifiers
| CAS Number | 185380-87-4 |
|---|---|
| SMILES | CCCCCC1(C2N(CCN1)C(=O)CS2)C.Cl |
Product Overview
2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride (CAS 185380-87-4), with molecular formula C12H23ClN2OS and molecular weight 278.12 g/mol. IUPAC: 8-methyl-8-pentyl-5,6,7,8a-tetrahydro-[1,3]thiazolo[3,2-a]pyrazin-3-one;hydrochloride.
Chemical Property Profile of 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride
Property Insights of 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride
The XLogP value of 2.2519 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride. With a topological polar surface area (TPSA) of 32.34 Ų, 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride 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 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride?
The CAS number of 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride is 185380-87-4.
What is the molecular formula of 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride?
The molecular formula of 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride is C12H23ClN2OS.
What is the molecular weight of 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride?
The molecular weight of 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride is 278.12 g/mol.
Where can I buy 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride?
You can request a quote for 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-2-pentyl-9-thia-3,6-diazabicyclo[4.3.0]nonan-7-one, chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.