哌罗匹隆
TL;DR: 哌罗匹隆 (CAS 150915-41-6) is a chemical compound with molecular formula C23H30N4O2S and molecular weight 426.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
哌罗匹隆
(3aR,7aS)-2-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
Also Known As: Perospirone, Lullan, perospirona, Perospirone [INN], perospironum
| Molecular Formula | C23H30N4O2S |
|---|---|
| Molecular Weight | 426.21 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 85.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.20895 |
| Heavy Atoms | 30 |
| Complexity | 615.0 |
| Melting Point | 95-97 as hydrochloride form |
Chemical Identifiers
| CAS Number | 150915-41-6 |
|---|---|
| SMILES | C1CC[C@H]2[C@@H](C1)C(=O)N(C2=O)CCCCN3CCN(CC3)C4=NSC5=CC=CC=C54 |
| InChIKey | FBVFZWUMDDXLLG-HDICACEKSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
哌罗匹隆 (CAS 150915-41-6), with molecular formula C23H30N4O2S and molecular weight 426.21 g/mol. IUPAC: (3aR,7aS)-2-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione.
Chemical Property Profile of 哌罗匹隆
Property Insights of 哌罗匹隆
The XLogP value of 3.9 indicates that 哌罗匹隆 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 哌罗匹隆. Following Lipinski's Rule of Five, 哌罗匹隆 has 0 hydrogen bond donor(s) and 6 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 哌罗匹隆?
The CAS number of 哌罗匹隆 is 150915-41-6.
What is the molecular formula of 哌罗匹隆?
The molecular formula of 哌罗匹隆 is C23H30N4O2S.
What is the molecular weight of 哌罗匹隆?
The molecular weight of 哌罗匹隆 is 426.21 g/mol.
Where can I buy 哌罗匹隆?
You can request a quote for 哌罗匹隆 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 哌罗匹隆?
Yes, KEHONG BIO provides custom synthesis services for 哌罗匹隆 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.