C25H30ClNO5
TL;DR: C25H30ClNO5 (CAS 14976-57-9) is a chemical compound with molecular formula C25H30ClNO5 and molecular weight 459.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-2-enedioic acid;(2R)-2-[2-[(1R)-1-(4-chlorophenyl)-1-phenylethoxy]ethyl]-1-methylpyrrolidine
Also Known As: Mecloprodine, Aloginan, Alphamin, Anhistan, Clemanil
| Molecular Formula | C25H30ClNO5 |
|---|---|
| Molecular Weight | 459.18 g/mol |
| LogP | 4.82 |
| Topological Polar Surface Area | 87.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 459.18124 |
| Heavy Atoms | 32 |
| Complexity | 495.0 |
Chemical Identifiers
| CAS Number | 14976-57-9 |
|---|---|
| SMILES | C[C@@](C1=CC=CC=C1)(C2=CC=C(C=C2)Cl)OCC[C@H]3CCCN3C.C(=CC(=O)O)C(=O)O |
| InChIKey | PMGQWSIVQFOFOQ-MUCZFFFMSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
C25H30ClNO5 (CAS 14976-57-9), with molecular formula C25H30ClNO5 and molecular weight 459.18 g/mol. IUPAC: but-2-enedioic acid;(2R)-2-[2-[(1R)-1-(4-chlorophenyl)-1-phenylethoxy]ethyl]-1-methylpyrrolidine.
Chemical Property Profile of C25H30ClNO5
Property Insights of C25H30ClNO5
The XLogP value of 4.82 indicates that C25H30ClNO5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.1 Ų falls within the moderate polarity range, balancing permeability and solubility for C25H30ClNO5. Following Lipinski's Rule of Five, C25H30ClNO5 has 2 hydrogen bond donor(s) and 6 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 C25H30ClNO5?
The CAS number of C25H30ClNO5 is 14976-57-9.
What is the molecular formula of C25H30ClNO5?
The molecular formula of C25H30ClNO5 is C25H30ClNO5.
What is the molecular weight of C25H30ClNO5?
The molecular weight of C25H30ClNO5 is 459.18 g/mol.
Where can I buy C25H30ClNO5?
You can request a quote for C25H30ClNO5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C25H30ClNO5?
Yes, KEHONG BIO provides custom synthesis services for C25H30ClNO5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.