3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate
TL;DR: 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate (CAS 157023-85-3) is a chemical compound with molecular formula C16H21ClN4O3S and molecular weight 384.1023 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-(diethylamino)ethyl]-5,5-dioxo-10H-pyridazino[4,5-b][1,4]benzothiazin-4-one;hydrochloride
Also Known As: 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate, 3-(2-diethylaminoethyl)-5,5-dioxo-10H-pyridazino[4,5-b][1,4]benzothiazin-4-one hydrochloride, 3-[2-(Diethylamino)ethyl]-5lambda~6~-pyridazino[4,5-b][1,4]benzothiazine-4,5,5(3H,10H)-trione--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C16H21ClN4O3S |
| Molecular Weight | 384.1023 g/mol |
| XLogP | 1.8967 |
| Topological Polar Surface Area (TPSA) | 90.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.1023 Da |
| Heavy Atoms | 25 |
| Complexity | 661.0 |
| SMILES | CCN(CC)CCN1C(=O)C2=C(C=N1)NC3=CC=CC=C3S2(=O)=O.Cl |
| InChIKey | OBSFLIKSIXBUOV-UHFFFAOYSA-N |
Chemical Property Profile of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate
Property Insights of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate
The XLogP value of 1.8967 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate. The TPSA of 90.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate. Following Lipinski's Rule of Five, 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate?
The CAS number of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate is 157023-85-3.
What is the molecular formula of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate?
The molecular formula of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate is C16H21ClN4O3S.
What is the molecular weight of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate?
The molecular weight of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate is 384.1023 g/mol.
Where can I buy 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate?
You can request a quote for 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate?
Yes, CoreyChem provides custom synthesis services for 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(2-(diethylamino)ethyl)-, 5,5-dioxide, monohydrochloride, hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.