3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide
TL;DR: 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide (CAS 691370-25-9) is a chemical compound with molecular formula C12H22N2OS and molecular weight 242.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-N-(piperidine-1-carbothioyl)butanamide
Also Known As: SDCCGSBI-0660701.P001, 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide, AS-871/43476281, 3,3-dimethyl-N-(piperidine-1-carbothioyl)butanamide
| Molecular Formula | C12H22N2OS |
|---|---|
| Molecular Weight | 242.15 g/mol |
| LogP | 2.3096 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 242.14528 |
| Heavy Atoms | 16 |
| Complexity | 264.68256 |
Chemical Identifiers
| CAS Number | 691370-25-9 |
|---|---|
| SMILES | CC(C)(C)CC(=O)NC(=S)N1CCCCC1 |
Product Overview
3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide (CAS 691370-25-9), with molecular formula C12H22N2OS and molecular weight 242.15 g/mol. IUPAC: 3,3-dimethyl-N-(piperidine-1-carbothioyl)butanamide.
Chemical Property Profile of 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide
Property Insights of 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide
The XLogP value of 2.3096 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide. With a topological polar surface area (TPSA) of 32.34 Ų, 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide has 1 hydrogen bond donor(s) and 2 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 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide?
The CAS number of 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide is 691370-25-9.
What is the molecular formula of 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide?
The molecular formula of 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide is C12H22N2OS.
What is the molecular weight of 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide?
The molecular weight of 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide is 242.15 g/mol.
Where can I buy 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide?
You can request a quote for 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for 3,3-dimethyl-N-(1-piperidinylcarbothioyl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.