4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol
TL;DR: 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol (CAS 55393-03-8) is a chemical compound with molecular formula C11H12N2OS and molecular weight 220.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,4,5-tetrahydro-[1,4]thiazepino[4,3-a]benzimidazol-4-ol
Also Known As: BAS 10319209, BB 0219691, 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol, 1,3,4,5-tetrahydrobenzo[4,5]imidazo[2,1-c][1,4]thiazepin-4-ol, F0852-0196
| Molecular Formula | C11H12N2OS |
|---|---|
| Molecular Weight | 220.07 g/mol |
| LogP | 1.644 |
| Topological Polar Surface Area | 38.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 220.06703 |
| Heavy Atoms | 15 |
| Complexity | 494.2936 |
Chemical Identifiers
| CAS Number | 55393-03-8 |
|---|---|
| SMILES | C1C(CSCC2=NC3=CC=CC=C3N21)O |
Product Overview
4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol (CAS 55393-03-8), with molecular formula C11H12N2OS and molecular weight 220.07 g/mol. IUPAC: 1,3,4,5-tetrahydro-[1,4]thiazepino[4,3-a]benzimidazol-4-ol.
Chemical Property Profile of 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol
Property Insights of 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol
The XLogP value of 1.644 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol. With a topological polar surface area (TPSA) of 38.05 Ų, 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol 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 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol?
The CAS number of 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol is 55393-03-8.
What is the molecular formula of 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol?
The molecular formula of 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol is C11H12N2OS.
What is the molecular weight of 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol?
The molecular weight of 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol is 220.07 g/mol.
Where can I buy 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol?
You can request a quote for 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol?
Yes, KEHONG BIO provides custom synthesis services for 4,5-dihydro-1H,3H-[1,4]thiazepino[4,3-a]benzimidazol-4-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.