![5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉 structure](/static/products/8037/80373-22-4.webp)
5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉
TL;DR: 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉 (CAS 80373-22-4) is a chemical compound with molecular formula C13H21N3 and molecular weight 219.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉
5-propyl-1,4,4a,6,7,8,8a,9-octahydropyrazolo[5,4-g]quinoline
Also Known As: Quinpirole dihydrochloride, (4aR-trans)-; (-)-Quinpirole, (A+/-)-Quinpirole dihydrochloride, 5-propyl-1,4,4a,6,7,8,8a,9-octahydropyrazolo[3,4-g]quinoline, BRD-A85280935-003-01-7
| Molecular Formula | C13H21N3 |
|---|---|
| Molecular Weight | 219.17 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 31.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.17355 |
| Heavy Atoms | 16 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 80373-22-4 |
|---|---|
| SMILES | CCCN1CCCC2C1CC3=C(C2)NN=C3 |
| InChIKey | FTSUPYGMFAPCFZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉 (CAS 80373-22-4), with molecular formula C13H21N3 and molecular weight 219.17 g/mol. IUPAC: 5-propyl-1,4,4a,6,7,8,8a,9-octahydropyrazolo[5,4-g]quinoline.
Chemical Property Profile of 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉
Property Insights of 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉. With a topological polar surface area (TPSA) of 31.9 Ų, 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉 has 1 hydrogen bond donor(s) and 2 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 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉?
The CAS number of 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉 is 80373-22-4.
What is the molecular formula of 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉?
The molecular formula of 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉 is C13H21N3.
What is the molecular weight of 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉?
The molecular weight of 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉 is 219.17 g/mol.
Where can I buy 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉?
You can request a quote for 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉?
Yes, KEHONG BIO provides custom synthesis services for 5-丙基-1,4,4a,6,7,8,8a,9-八氢吡唑并[3,4-g]喹啉 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.