3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2)
TL;DR: 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2) (CAS 157023-80-8) is a chemical compound with molecular formula C15H19ClN4O4S and molecular weight 386.08154 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-dimethyl-3-(4,5,5-trioxo-10H-pyridazino[4,5-b][1,4]benzothiazin-3-yl)propan-1-amine oxide;hydrochloride
Also Known As: 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2), N,N-dimethyl-3-(4,5,5-trioxo-10H-pyridazino[4,5-b][1,4]benzothiazin-3-yl)propan-1-amine oxide hydrochloride, N,N-Dimethyl-3-(4,5,5-trioxo-5,10-dihydro-5lambda~6~-pyridazino[4,5-b][1,4]benzothiazin-3(4H)-yl)propan-1-amine N-oxide--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C15H19ClN4O4S |
| Molecular Weight | 386.08154 g/mol |
| XLogP | 1.5192 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 386.08154 Da |
| Heavy Atoms | 25 |
| Complexity | 693.0 |
| SMILES | C[N+](C)(CCCN1C(=O)C2=C(C=N1)NC3=CC=CC=C3S2(=O)=O)[O-].Cl |
| InChIKey | ONWPAAHAALBDRG-UHFFFAOYSA-N |
Chemical Property Profile of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2)
Property Insights of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2)
The XLogP value of 1.5192 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2). The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2). Following Lipinski's Rule of Five, 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2) 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-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2)?
The CAS number of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2) is 157023-80-8.
What is the molecular formula of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2)?
The molecular formula of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2) is C15H19ClN4O4S.
What is the molecular weight of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2)?
The molecular weight of 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2) is 386.08154 g/mol.
Where can I buy 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2)?
You can request a quote for 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2) 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-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2)?
Yes, CoreyChem provides custom synthesis services for 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 3-(3-(dimethylamino)propyl)-, N,5,5-trioxide, hydrochloride, hydrate (1:1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.