Northiadene HCl
TL;DR: Northiadene HCl (CAS 844-12-2) is a chemical compound with molecular formula C18H20ClNS and molecular weight 317.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3Z)-3-(6H-benzo[c][1]benzothiepin-11-ylidene)propyl]-methylazanium chloride
Also Known As: Northiadene HCl, Northiadene hydrochloride, trans-11-(3-Methylaminopropylidene)-6,11-dihydrodibenzo(b,e)thiepine hydrochloride, Dibenzo(b,e)thiepin-delta(sup 11(6H),gamma)-propylamine, N-methyl-, hydrochloride, [(3Z)-3-(6H-benzo[c][1]benzothiepin-11-ylidene)propyl]-methylazanium chloride
| Molecular Formula | C18H20ClNS |
|---|---|
| Molecular Weight | 317.10 g/mol |
| LogP | 0.3113 |
| Topological Polar Surface Area | 16.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.1005 |
| Heavy Atoms | 21 |
| Complexity | 587.12036 |
Chemical Identifiers
| CAS Number | 844-12-2 |
|---|---|
| SMILES | C[NH2+]CC/C=C\1/C2=CC=CC=C2CSC3=CC=CC=C31.[Cl-] |
Product Overview
Northiadene HCl (CAS 844-12-2), with molecular formula C18H20ClNS and molecular weight 317.10 g/mol. IUPAC: [(3Z)-3-(6H-benzo[c][1]benzothiepin-11-ylidene)propyl]-methylazanium chloride.
Chemical Property Profile of Northiadene HCl
Property Insights of Northiadene HCl
The XLogP value of 0.3113 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Northiadene HCl. With a topological polar surface area (TPSA) of 16.61 Ų, Northiadene HCl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Northiadene HCl has 1 hydrogen bond donor(s) and 1 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 Northiadene HCl?
The CAS number of Northiadene HCl is 844-12-2.
What is the molecular formula of Northiadene HCl?
The molecular formula of Northiadene HCl is C18H20ClNS.
What is the molecular weight of Northiadene HCl?
The molecular weight of Northiadene HCl is 317.10 g/mol.
Where can I buy Northiadene HCl?
You can request a quote for Northiadene HCl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Northiadene HCl?
Yes, KEHONG BIO provides custom synthesis services for Northiadene HCl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.