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6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺
TL;DR: 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺 (CAS 50741-66-7) is a chemical compound with molecular formula C15H13NOS and molecular weight 255.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺
6,11-dihydrobenzo[c][1]benzothiepine-11-carboxamide
Also Known As: DIBENZO(b,e)THIEPIN-11-CARBOXAMIDE, 6,11-DIHYDRO-, 6,11-Dihydrodibenzo(b,e)thiepin-11-carboxamide, 6,11-dihydrobenzo[c][1]benzothiepine-11-carboxamide, 6,11-dihydrodibenzo[b,e]thiepine-11-carboxamide, 6,11-Dihydrodibenzo
| Molecular Formula | C15H13NOS |
|---|---|
| Molecular Weight | 255.07 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 68.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 255.0718 |
| Heavy Atoms | 18 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 50741-66-7 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(C3=CC=CC=C3S1)C(=O)N |
| InChIKey | KWMIYIVKXATREY-UHFFFAOYSA-N |
Product Overview
6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺 (CAS 50741-66-7), with molecular formula C15H13NOS and molecular weight 255.07 g/mol. IUPAC: 6,11-dihydrobenzo[c][1]benzothiepine-11-carboxamide.
Chemical Property Profile of 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺
Property Insights of 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺. The TPSA of 68.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺. Following Lipinski's Rule of Five, 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺 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 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺?
The CAS number of 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺 is 50741-66-7.
What is the molecular formula of 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺?
The molecular formula of 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺 is C15H13NOS.
What is the molecular weight of 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺?
The molecular weight of 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺 is 255.07 g/mol.
Where can I buy 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺?
You can request a quote for 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for 6,11-二氢二苯并[b,e]硫杂环庚-11-甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.