2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione
TL;DR: 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione (CAS 47328-55-2) is a chemical compound with molecular formula C19H30N2O2S and molecular weight 350.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hexyl-3-pentyl-5H-1λ6,2,4-benzothiadiazepine 1,1-dioxide
Also Known As: 2-hexyl-3-pentyl-5H-1, 2,5-Dihydro-2-hexyl-3-pentyl-1,2,4-benzothiadiazepine 1,1-dioxide, 1,2,4-Benzothiadiazepine, 2,5-dihydro-2-hexyl-3-pentyl-, 1,1-dioxide, E6,2,4-benzothiadiazepine 1,1-dioxide, 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione
| Molecular Formula | C19H30N2O2S |
|---|---|
| Molecular Weight | 350.20 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 58.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 350.2028 |
| Heavy Atoms | 24 |
| Complexity | 496.0 |
Chemical Identifiers
| CAS Number | 47328-55-2 |
|---|---|
| SMILES | CCCCCCN1C(=NCC2=CC=CC=C2S1(=O)=O)CCCCC |
| InChIKey | NKKCMMTTWVGXCV-UHFFFAOYSA-N |
Product Overview
2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione (CAS 47328-55-2), with molecular formula C19H30N2O2S and molecular weight 350.20 g/mol. IUPAC: 2-hexyl-3-pentyl-5H-1λ6,2,4-benzothiadiazepine 1,1-dioxide.
Chemical Property Profile of 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione
Property Insights of 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione
The XLogP value of 4.7 indicates that 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.1 Ų, 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione has 0 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-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione?
The CAS number of 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione is 47328-55-2.
What is the molecular formula of 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione?
The molecular formula of 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione is C19H30N2O2S.
What is the molecular weight of 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione?
The molecular weight of 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione is 350.20 g/mol.
Where can I buy 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione?
You can request a quote for 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-Hexyl-3-pentyl-2,5-dihydro-1H-1lambda~6~,2,4-benzothiadiazepine-1,1-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.