中卟啉二甲酯
TL;DR: 中卟啉二甲酯 (CAS 1263-63-4) is a chemical compound with molecular formula C36H42N4O4 and molecular weight 594.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
中卟啉二甲酯
methyl 3-[8,13-diethyl-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate
Also Known As: Mesoporphyrin ix dimethyl ester, Mesoporphyrin dimethyl ester, Mesoporphyrin IX dimethylester, mesoporphyrin dimethyl ether, Mesoporphyrin dimethyl ester (VAN)
| Molecular Formula | C36H42N4O4 |
|---|---|
| Molecular Weight | 594.32 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 594.3206 |
| Heavy Atoms | 44 |
| Complexity | 980.0 |
Chemical Identifiers
| CAS Number | 1263-63-4 |
|---|---|
| SMILES | CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)OC)CCC(=O)OC)C)C)CC)C |
| InChIKey | CQKDGYMHYLBWTQ-UHFFFAOYSA-N |
Product Overview
中卟啉二甲酯 (CAS 1263-63-4), with molecular formula C36H42N4O4 and molecular weight 594.32 g/mol. IUPAC: methyl 3-[8,13-diethyl-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate.
Chemical Property Profile of 中卟啉二甲酯
Property Insights of 中卟啉二甲酯
The XLogP value of 5.3 indicates that 中卟啉二甲酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 中卟啉二甲酯. Following Lipinski's Rule of Five, 中卟啉二甲酯 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 中卟啉二甲酯?
The CAS number of 中卟啉二甲酯 is 1263-63-4.
What is the molecular formula of 中卟啉二甲酯?
The molecular formula of 中卟啉二甲酯 is C36H42N4O4.
What is the molecular weight of 中卟啉二甲酯?
The molecular weight of 中卟啉二甲酯 is 594.32 g/mol.
Where can I buy 中卟啉二甲酯?
You can request a quote for 中卟啉二甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 中卟啉二甲酯?
Yes, KEHONG BIO provides custom synthesis services for 中卟啉二甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.