螺朵林
TL;DR: 螺朵林 (CAS 87151-85-7) is a chemical compound with molecular formula C22H30Cl2N2O2 and molecular weight 424.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
螺朵林
2-(3,4-dichlorophenyl)-N-methyl-N-[(5R,7S,8S)-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-8-yl]acetamide
Also Known As: SPIRADOLINE, Espiradolina, Spiradolinum, Spiradoline [INN], Spiradolinum [Latin]
| Molecular Formula | C22H30Cl2N2O2 |
|---|---|
| Molecular Weight | 424.17 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 424.16843 |
| Heavy Atoms | 28 |
| Complexity | 557.0 |
Chemical Identifiers
| CAS Number | 87151-85-7 |
|---|---|
| SMILES | CN([C@H]1CC[C@@]2(CCCO2)C[C@@H]1N3CCCC3)C(=O)CC4=CC(=C(C=C4)Cl)Cl |
| InChIKey | NYKCGQQJNVPOLU-ONTIZHBOSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
螺朵林 (CAS 87151-85-7), with molecular formula C22H30Cl2N2O2 and molecular weight 424.17 g/mol. IUPAC: 2-(3,4-dichlorophenyl)-N-methyl-N-[(5R,7S,8S)-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-8-yl]acetamide.
Chemical Property Profile of 螺朵林
Property Insights of 螺朵林
The XLogP value of 4.3 indicates that 螺朵林 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, 螺朵林 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 螺朵林 has 0 hydrogen bond donor(s) and 3 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 螺朵林?
The CAS number of 螺朵林 is 87151-85-7.
What is the molecular formula of 螺朵林?
The molecular formula of 螺朵林 is C22H30Cl2N2O2.
What is the molecular weight of 螺朵林?
The molecular weight of 螺朵林 is 424.17 g/mol.
Where can I buy 螺朵林?
You can request a quote for 螺朵林 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 螺朵林?
Yes, KEHONG BIO provides custom synthesis services for 螺朵林 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.