赛乐西帕
TL;DR: 赛乐西帕 (CAS 475086-01-2) is a chemical compound with molecular formula C26H32N4O4S and molecular weight 496.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
赛乐西帕
2-[4-[(5,6-diphenylpyrazin-2-yl)-propan-2-ylamino]butoxy]-N-methylsulfonylacetamide
Also Known As: Selexipag, Uptravi, selexipagum, Uptravi (TN), NS 304
| Molecular Formula | C26H32N4O4S |
|---|---|
| Molecular Weight | 496.21 g/mol |
| LogP | 3.898 |
| Topological Polar Surface Area | 101.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 496.21442 |
| Heavy Atoms | 35 |
| Complexity | 1202.5361 |
Chemical Identifiers
| CAS Number | 475086-01-2 |
|---|---|
| SMILES | CC(C)N(CCCCOCC(=O)NS(=O)(=O)C)C1=CN=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
赛乐西帕 (CAS 475086-01-2), with molecular formula C26H32N4O4S and molecular weight 496.21 g/mol. IUPAC: 2-[4-[(5,6-diphenylpyrazin-2-yl)-propan-2-ylamino]butoxy]-N-methylsulfonylacetamide.
Chemical Property Profile of 赛乐西帕
Property Insights of 赛乐西帕
The XLogP value of 3.898 indicates that 赛乐西帕 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 赛乐西帕. Following Lipinski's Rule of Five, 赛乐西帕 has 1 hydrogen bond donor(s) and 7 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 赛乐西帕?
The CAS number of 赛乐西帕 is 475086-01-2.
What is the molecular formula of 赛乐西帕?
The molecular formula of 赛乐西帕 is C26H32N4O4S.
What is the molecular weight of 赛乐西帕?
The molecular weight of 赛乐西帕 is 496.21 g/mol.
Where can I buy 赛乐西帕?
You can request a quote for 赛乐西帕 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 赛乐西帕?
Yes, KEHONG BIO provides custom synthesis services for 赛乐西帕 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.