N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine
TL;DR: N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine (CAS 900640-84-8) is a chemical compound with molecular formula C9H13NO2S2 and molecular weight 231.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dioxo-N-(thiophen-2-ylmethyl)thiolan-3-amine
Also Known As: 1,1-dioxo-N-(thiophen-2-ylmethyl)thiolan-3-amine, N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine, 3-[(2-thienylmethyl)amino]thiolane-1,1-dione, 3-{[(thiophen-2-yl)methyl]amino}-1lambda6-thiolane-1,1-dione, 3-((Thiophen-2-ylmethyl)amino)tetrahydrothiophene 1,1-dioxide
| Molecular Formula | C9H13NO2S2 |
|---|---|
| Molecular Weight | 231.04 g/mol |
| LogP | 1.0248 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.03877 |
| Heavy Atoms | 14 |
| Complexity | 382.95428 |
Chemical Identifiers
| CAS Number | 900640-84-8 |
|---|---|
| SMILES | C1CS(=O)(=O)CC1NCC2=CC=CS2 |
Product Overview
N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine (CAS 900640-84-8), with molecular formula C9H13NO2S2 and molecular weight 231.04 g/mol. IUPAC: 1,1-dioxo-N-(thiophen-2-ylmethyl)thiolan-3-amine.
Chemical Property Profile of N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine
Property Insights of N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine
The XLogP value of 1.0248 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine. With a topological polar surface area (TPSA) of 46.17 Ų, N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine 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 N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine?
The CAS number of N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine is 900640-84-8.
What is the molecular formula of N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine?
The molecular formula of N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine is C9H13NO2S2.
What is the molecular weight of N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine?
The molecular weight of N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine is 231.04 g/mol.
Where can I buy N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine?
You can request a quote for N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine?
Yes, KEHONG BIO provides custom synthesis services for N-(1,1-dioxidotetrahydrothien-3-yl)-N-(thien-2-ylmethyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.