![6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol structure](/static/products/800/80008-55-5.png)
6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol
TL;DR: 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol (CAS 80008-55-5) is a chemical compound with molecular formula C12H11NOS and molecular weight 217.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol
Also Known As: 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol, 6,7-Dihydropyrrolo(2,1-d)(1,5)benzothiazepin-7-ol
| Molecular Formula | C12H11NOS |
|---|---|
| Molecular Weight | 217.06 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 50.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 217.05614 |
| Heavy Atoms | 15 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 80008-55-5 |
|---|---|
| SMILES | C1C(C2=CC=CN2C3=CC=CC=C3S1)O |
| InChIKey | OURJFZBVOQLNDN-UHFFFAOYSA-N |
Product Overview
6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol (CAS 80008-55-5), with molecular formula C12H11NOS and molecular weight 217.06 g/mol. IUPAC: 6,7-dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol.
Chemical Property Profile of 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol
Property Insights of 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol. With a topological polar surface area (TPSA) of 50.5 Ų, 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol 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 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol?
The CAS number of 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol is 80008-55-5.
What is the molecular formula of 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol?
The molecular formula of 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol is C12H11NOS.
What is the molecular weight of 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol?
The molecular weight of 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol is 217.06 g/mol.
Where can I buy 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol?
You can request a quote for 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.