凯坦色林
TL;DR: 凯坦色林 (CAS 74050-98-9) is a chemical compound with molecular formula C22H22FN3O3 and molecular weight 395.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
凯坦色林
3-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione
Also Known As: Ketanserin, Ketanserine, Ketanserin tartrate, Ketanserina, Ketanserinum
| Molecular Formula | C22H22FN3O3 |
|---|---|
| Molecular Weight | 395.16 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.16452 |
| Heavy Atoms | 29 |
| Complexity | 627.0 |
Chemical Identifiers
| CAS Number | 74050-98-9 |
|---|---|
| SMILES | C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCN3C(=O)C4=CC=CC=C4NC3=O |
| InChIKey | FPCCSQOGAWCVBH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
凯坦色林 (CAS 74050-98-9), with molecular formula C22H22FN3O3 and molecular weight 395.16 g/mol. IUPAC: 3-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione.
Chemical Property Profile of 凯坦色林
Property Insights of 凯坦色林
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 凯坦色林. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 凯坦色林. Following Lipinski's Rule of Five, 酮色林 has 1 hydrogen bond donor(s) and 5 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 酮色林?
The CAS number of 酮色林 is 74050-98-9.
What is the molecular formula of 酮色林?
The molecular formula of 酮色林 is C22H22FN3O3.
What is the molecular weight of 酮色林?
The molecular weight of 酮色林 is 395.16 g/mol.
Where can I buy 酮色林?
You can request a quote for 酮色林 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 酮色林?
Yes, KEHONG BIO provides custom synthesis services for 酮色林 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.