异克舒令
TL;DR: 异克舒令 (CAS 395-28-8) is a chemical compound with molecular formula C18H23NO3 and molecular weight 301.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异克舒令
4-[1-hydroxy-2-(1-phenoxypropan-2-ylamino)propyl]phenol
Also Known As: isoxsuprine, Vasodilian, Dilavase, Duvadilan, Vasosurpine
| Molecular Formula | C18H23NO3 |
|---|---|
| Molecular Weight | 301.17 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 61.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 301.1678 |
| Heavy Atoms | 22 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 395-28-8 |
|---|---|
| SMILES | CC(COC1=CC=CC=C1)NC(C)C(C2=CC=C(C=C2)O)O |
| InChIKey | BMUKKTUHUDJSNZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
异克舒令 (CAS 395-28-8), with molecular formula C18H23NO3 and molecular weight 301.17 g/mol. IUPAC: 4-[1-hydroxy-2-(1-phenoxypropan-2-ylamino)propyl]phenol.
Chemical Property Profile of 异克舒令
Property Insights of 异克舒令
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 异克舒令. The TPSA of 61.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 异克舒令. Following Lipinski's Rule of Five, 異蘇氨酸 has 3 hydrogen bond donor(s) and 4 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 異蘇氨酸?
The CAS number of 異蘇氨酸 is 395-28-8.
What is the molecular formula of 異蘇氨酸?
The molecular formula of 異蘇氨酸 is C18H23NO3.
What is the molecular weight of 異蘇氨酸?
The molecular weight of 異蘇氨酸 is 301.17 g/mol.
Where can I buy 異蘇氨酸?
You can request a quote for 異蘇氨酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 異蘇氨酸?
Yes, KEHONG BIO provides custom synthesis services for 異蘇氨酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.