吗替麦考酚酯
TL;DR: 吗替麦考酚酯 (CAS 128794-94-5) is a chemical compound with molecular formula C23H31NO7 and molecular weight 433.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吗替麦考酚酯
2-morpholin-4-ylethyl 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
Also Known As: mycophenolate mofetil, Mycophenolate Mofetil-d4, Mycophenolate Mofetil (E/Z mixture), Mycophenolate Mofetil Impurity 32, Mycophenolate Mofetil (Rs-61443)
| Molecular Formula | C23H31NO7 |
|---|---|
| Molecular Weight | 433.21 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 94.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 433.21005 |
| Heavy Atoms | 31 |
| Complexity | 646.0 |
Chemical Identifiers
| CAS Number | 128794-94-5 |
|---|---|
| SMILES | CC1=C2COC(=O)C2=C(C(=C1OC)CC=C(C)CCC(=O)OCCN3CCOCC3)O |
| InChIKey | RTGDFNSFWBGLEC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
吗替麦考酚酯 (CAS 128794-94-5), with molecular formula C23H31NO7 and molecular weight 433.21 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.
Chemical Property Profile of 吗替麦考酚酯
Property Insights of 吗替麦考酚酯
The XLogP value of 3.2 indicates that 吗替麦考酚酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 吗替麦考酚酯. Following Lipinski's Rule of Five, 吗替麦考酚酯 has 1 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 吗替麦考酚酯?
The CAS number of 吗替麦考酚酯 is 128794-94-5.
What is the molecular formula of 吗替麦考酚酯?
The molecular formula of 吗替麦考酚酯 is C23H31NO7.
What is the molecular weight of 吗替麦考酚酯?
The molecular weight of 吗替麦考酚酯 is 433.21 g/mol.
Where can I buy 吗替麦考酚酯?
You can request a quote for 吗替麦考酚酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 吗替麦考酚酯?
Yes, KEHONG BIO provides custom synthesis services for 吗替麦考酚酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.