Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride
TL;DR: Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride (CAS 82394-04-5) is a chemical compound with molecular formula C16H18ClNOS and molecular weight 307.07977 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)methylazanium chloride
Also Known As: 6,11-Dihydro-4-methoxydibenzo(b,e)thiepin-11-methanamine hydrochloride, 11-(Aminomethyl)-4-methoxy-6,11-dihydrodibenzo(b,e)thiepin hydrochloride, DIBENZO(b,e)THIEPIN-11-METHANAMINE, 6,11-DIHYDRO-4-METHOXY-, HYDROCHLORIDE, (4-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)methylazaniumchloride, (4-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)methanamine;hydrochloride
Technical Specifications
| Molecular Formula | C16H18ClNOS |
| Molecular Weight | 307.07977 g/mol |
| XLogP | -0.32 |
| Topological Polar Surface Area (TPSA) | 62.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.07977 Da |
| Heavy Atoms | 20 |
| Complexity | 298.0 |
| SMILES | COC1=CC=CC2=C1SCC3=CC=CC=C3C2C[NH3+].[Cl-] |
| InChIKey | PXGYEECDKXXTOQ-UHFFFAOYSA-N |
Chemical Property Profile of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride
Property Insights of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride
The XLogP value of -0.32 indicates that Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride. Following Lipinski's Rule of Five, Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride 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
What is the CAS number of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride?
The CAS number of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride is 82394-04-5.
What is the molecular formula of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride?
The molecular formula of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride is C16H18ClNOS.
What is the molecular weight of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride?
The molecular weight of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride is 307.07977 g/mol.
Where can I buy Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride?
You can request a quote for Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride?
Yes, CoreyChem provides custom synthesis services for Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-4-methoxy-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.