RefChem:297944
TL;DR: RefChem:297944 (CAS 4579-60-6) is a chemical compound with molecular formula C16H21ClN2S and molecular weight 308.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4,5-dihydrothieno[3,2-b][1]benzazepin-10-yl)-N-methylpropan-1-amine;hydrochloride
Also Known As: [5-(Trifluoromethyl)pyridin-2-yl]acetylene|9,10-Dihydro-N-methyl-4H-thieno(3,2-b)(1)benzazepine-4-propanamine monohydrochloride|4-(gamma-Methylaminopropyl)-9,10-dihydro-(4H)-thieno-(3,2-b)(f)-benzazepine hydrochloride|4H-Thieno(3,2-b)(1)benzazepine-4-propanamine, 9,10-dihydro-N-methyl-, monohydrochloride|3-(9,10-dihydro-4h-thieno[3,2-b][1]benzazepin-4-yl)-n-methylpropan-1-amine hydrochloride(1:1)|[3-(9,10-Dihydro-1-thia-4-aza-benzo[f]azulen-4-yl)-propyl]-methyl-amine; hydrochloride|3-(4,5-dihydrothieno[3,2-b][1]benzazepin-10-yl)-N-methylpropan-1-amine hydrochloride|3-(9,10-Dihydro-4H-thieno[3,2-b][1]benzazepin-4-yl)-N-methylpropan-1-amine--hydrogen chloride (1/1)|RefChem:297944
| Molecular Formula | C16H21ClN2S |
|---|---|
| Molecular Weight | 308.11 g/mol |
| LogP | 4.0161 |
| Topological Polar Surface Area | 43.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.1114 |
| Heavy Atoms | 20 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 4579-60-6 |
|---|---|
| SMILES | CNCCCN1C2=C(CCC3=CC=CC=C31)SC=C2.Cl |
| InChIKey | DJEGNHUFBZWWMK-UHFFFAOYSA-N |
Product Overview
RefChem:297944 (CAS 4579-60-6), with molecular formula C16H21ClN2S and molecular weight 308.11 g/mol. IUPAC: 3-(4,5-dihydrothieno[3,2-b][1]benzazepin-10-yl)-N-methylpropan-1-amine;hydrochloride.
Chemical Property Profile of RefChem:297944
Property Insights of RefChem:297944
The XLogP value of 4.0161 indicates that RefChem:297944 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.5 Ų, RefChem:297944 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:297944 has 2 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 RefChem:297944?
The CAS number of RefChem:297944 is 4579-60-6.
What is the molecular formula of RefChem:297944?
The molecular formula of RefChem:297944 is C16H21ClN2S.
What is the molecular weight of RefChem:297944?
The molecular weight of RefChem:297944 is 308.11 g/mol.
Where can I buy RefChem:297944?
You can request a quote for RefChem:297944 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:297944?
Yes, KEHONG BIO provides custom synthesis services for RefChem:297944 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.