2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1)
TL;DR: 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1) (CAS 61982-32-9) is a chemical compound with molecular formula C19H24ClNS and molecular weight 333.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-4,4-diethyl-2,3-dihydro-1,3-benzothiazine;hydrochloride
Also Known As: 2-Benzyl-4,4-diethyl-2,3-dihydro-4H-1,3-benzothiazine hydrochloride, 4H-1,3-Benzothiazine, 2,3-dihydro-2-benzyl-4,4-diethyl-, hydrochloride, 2-benzyl-4,4-diethyl-2,3-dihydro-1,3-benzothiazine hydrochloride, 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1), RefChem:1062395
| Molecular Formula | C19H24ClNS |
|---|---|
| Molecular Weight | 333.13 g/mol |
| LogP | 5.3878 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.1318 |
| Heavy Atoms | 22 |
| Complexity | 595.394 |
Chemical Identifiers
| CAS Number | 61982-32-9 |
|---|---|
| SMILES | CCC1(C2=CC=CC=C2SC(N1)CC3=CC=CC=C3)CC.Cl |
Product Overview
2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1) (CAS 61982-32-9), with molecular formula C19H24ClNS and molecular weight 333.13 g/mol. IUPAC: 2-benzyl-4,4-diethyl-2,3-dihydro-1,3-benzothiazine;hydrochloride.
Chemical Property Profile of 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1)
Property Insights of 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1)
The XLogP value of 5.3878 indicates that 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1) has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1)?
The CAS number of 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1) is 61982-32-9.
What is the molecular formula of 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1)?
The molecular formula of 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1) is C19H24ClNS.
What is the molecular weight of 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1)?
The molecular weight of 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1) is 333.13 g/mol.
Where can I buy 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1)?
You can request a quote for 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzyl-4,4-diethyl-3,4-dihydro-2H-1,3-benzothiazine--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.