1-(5-异喹啉磺酰基)-2-甲基哌嗪
TL;DR: 1-(5-异喹啉磺酰基)-2-甲基哌嗪 (CAS 84477-87-2) is a chemical compound with molecular formula C14H17N3O2S and molecular weight 291.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-异喹啉磺酰基)-2-甲基哌嗪
5-(2-methylpiperazin-1-yl)sulfonylisoquinoline
Also Known As: Protein kinase inhibitor H-7, Isoquinoline deriv., H-7 dihydrochloride, H-7 inhibitor, 1-(5-ISOQUINOLINESULFONYL)-2-METHYLPIPERAZINE
| Molecular Formula | C14H17N3O2S |
|---|---|
| Molecular Weight | 291.10 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 70.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 291.10416 |
| Heavy Atoms | 20 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 84477-87-2 |
|---|---|
| SMILES | CC1CNCCN1S(=O)(=O)C2=CC=CC3=C2C=CN=C3 |
| InChIKey | BDVFVCGFMNCYPV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(5-异喹啉磺酰基)-2-甲基哌嗪 (CAS 84477-87-2), with molecular formula C14H17N3O2S and molecular weight 291.10 g/mol. IUPAC: 5-(2-methylpiperazin-1-yl)sulfonylisoquinoline.
Chemical Property Profile of 1-(5-异喹啉磺酰基)-2-甲基哌嗪
Property Insights of 1-(5-异喹啉磺酰基)-2-甲基哌嗪
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-异喹啉磺酰基)-2-甲基哌嗪. The TPSA of 70.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-异喹啉磺酰基)-2-甲基哌嗪. Following Lipinski's Rule of Five, 1-(5-Isoquinolinylsulfonyl)-2-Methylpiperazine has 1 hydrogen bond donor(s) and 5 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 1-(5-Isoquinolinylsulfonyl)-2-Methylpiperazine?
The CAS number of 1-(5-Isoquinolinylsulfonyl)-2-Methylpiperazine is 84477-87-2.
What is the molecular formula of 1-(5-Isoquinolinylsulfonyl)-2-Methylpiperazine?
The molecular formula of 1-(5-Isoquinolinylsulfonyl)-2-Methylpiperazine is C14H17N3O2S.
What is the molecular weight of 1-(5-Isoquinolinylsulfonyl)-2-Methylpiperazine?
The molecular weight of 1-(5-Isoquinolinylsulfonyl)-2-Methylpiperazine is 291.10 g/mol.
Where can I buy 1-(5-Isoquinolinylsulfonyl)-2-Methylpiperazine?
You can request a quote for 1-(5-Isoquinolinylsulfonyl)-2-Methylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Isoquinolinylsulfonyl)-2-Methylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Isoquinolinylsulfonyl)-2-Methylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.