6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde
TL;DR: 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde (CAS 164359-75-5) is a chemical compound with molecular formula C6H9NOS and molecular weight 143.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde
Also Known As: 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde, 6,7-Dihydro-1,4-thiazepine-4(5H)-carbaldehyde, 1,4-Thiazepine-4(5H)-carboxaldehyde, 6,7-dihydro- (9CI), 4,5,6,7-tetrahydro-1,4-thiazepine-4-carbaldehyde, 1,4-THIAZEPINE-4(5H)-CARBOXALDEHYDE, 6,7-DIHYDRO-
| Molecular Formula | C6H9NOS |
|---|---|
| Molecular Weight | 143.04 g/mol |
| LogP | 1.0529 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 143.04048 |
| Heavy Atoms | 9 |
| Complexity | 124.226265 |
Chemical Identifiers
| CAS Number | 164359-75-5 |
|---|---|
| SMILES | C1CN(C=CSC1)C=O |
Product Overview
6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde (CAS 164359-75-5), with molecular formula C6H9NOS and molecular weight 143.04 g/mol. IUPAC: 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde.
Chemical Property Profile of 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde
Property Insights of 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde
The XLogP value of 1.0529 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde. With a topological polar surface area (TPSA) of 20.31 Ų, 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde has 0 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 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde?
The CAS number of 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde is 164359-75-5.
What is the molecular formula of 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde?
The molecular formula of 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde is C6H9NOS.
What is the molecular weight of 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde?
The molecular weight of 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde is 143.04 g/mol.
Where can I buy 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde?
You can request a quote for 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 6,7-dihydro-5H-1,4-thiazepine-4-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.