Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide
TL;DR: Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide (CAS 164357-37-3) is a chemical compound with molecular formula C23H30N8O2S and molecular weight 482.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5,11,13-tetramethyl-7-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-8λ6-thia-3,4,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,5,10,12-pentaene 8,8-dioxide
Also Known As: Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide, 2,3,7,9-Tetramethyl-4-{3-[4-(pyrimidin-2-yl)piperazin-1-yl]propyl}-2,4-dihydro-5H-5lambda~6~-pyrazolo[4,3-c]pyrido[3,2-e][1,2]thiazine-5,5-dione, RefChem:376292
| Molecular Formula | C23H30N8O2S |
|---|---|
| Molecular Weight | 482.22 g/mol |
| LogP | 1.91836 |
| Topological Polar Surface Area | 100.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 482.22125 |
| Heavy Atoms | 34 |
| Complexity | 1314.4833 |
Chemical Identifiers
| CAS Number | 164357-37-3 |
|---|---|
| SMILES | CC1=CC(=NC2=C1C3=NN(C(=C3N(S2(=O)=O)CCCN4CCN(CC4)C5=NC=CC=N5)C)C)C |
Product Overview
Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide (CAS 164357-37-3), with molecular formula C23H30N8O2S and molecular weight 482.22 g/mol. IUPAC: 4,5,11,13-tetramethyl-7-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-8λ6-thia-3,4,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,5,10,12-pentaene 8,8-dioxide.
Chemical Property Profile of Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide
Property Insights of Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide
The XLogP value of 1.91836 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide. The TPSA of 100.35 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide. Following Lipinski's Rule of Five, Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide has 0 hydrogen bond donor(s) and 8 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 Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide?
The CAS number of Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide is 164357-37-3.
What is the molecular formula of Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide?
The molecular formula of Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide is C23H30N8O2S.
What is the molecular weight of Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide?
The molecular weight of Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide is 482.22 g/mol.
Where can I buy Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide?
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Does KEHONG BIO offer custom synthesis for Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide?
Yes, KEHONG BIO provides custom synthesis services for Pyrazolo(4,3-c)pyrido(3,2-e)(1,2)thiazine, 2,4-dihydro-4-(3-(4-(2-pyrimidinyl)-1-piperazinyl)propyl)-2,3,7,9-tetramethyl-, 5,5-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.