Mycophenolate mofetil hydrochloride
TL;DR: Mycophenolate mofetil hydrochloride (CAS 116680-01-4) is a chemical compound with molecular formula C23H32ClNO7 and molecular weight 469.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-morpholin-4-ylethyl 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate;hydrochloride
Also Known As: Mycophenolate mofetil hydrochloride, 2-morpholin-4-ylethyl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
| Molecular Formula | C23H32ClNO7 |
|---|---|
| Molecular Weight | 469.19 g/mol |
| LogP | 2.94582 |
| Topological Polar Surface Area | 94.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 469.18674 |
| Heavy Atoms | 32 |
| Complexity | 646.0 |
Chemical Identifiers
| CAS Number | 116680-01-4 |
|---|---|
| SMILES | CC1=C2COC(=O)C2=C(C(=C1OC)CC=C(C)CCC(=O)OCCN3CCOCC3)O.Cl |
| InChIKey | OWLCGJBUTJXNOF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Mycophenolate mofetil hydrochloride (CAS 116680-01-4), with molecular formula C23H32ClNO7 and molecular weight 469.19 g/mol. IUPAC: 2-morpholin-4-ylethyl 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate;hydrochloride.
Chemical Property Profile of Mycophenolate mofetil hydrochloride
Property Insights of Mycophenolate mofetil hydrochloride
The XLogP value of 2.94582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mycophenolate mofetil hydrochloride. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Mycophenolate mofetil hydrochloride. Following Lipinski's Rule of Five, Mycophenolate mofetil hydrochloride has 2 hydrogen bond donor(s) and 8 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 Mycophenolate mofetil hydrochloride?
The CAS number of Mycophenolate mofetil hydrochloride is 116680-01-4.
What is the molecular formula of Mycophenolate mofetil hydrochloride?
The molecular formula of Mycophenolate mofetil hydrochloride is C23H32ClNO7.
What is the molecular weight of Mycophenolate mofetil hydrochloride?
The molecular weight of Mycophenolate mofetil hydrochloride is 469.19 g/mol.
Where can I buy Mycophenolate mofetil hydrochloride?
You can request a quote for Mycophenolate mofetil hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mycophenolate mofetil hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Mycophenolate mofetil hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.