Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1
TL;DR: Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1 (CAS 69804-55-3) is a chemical compound with molecular formula C37H47N5O2 and molecular weight 593.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-23,24-dihydroporphyrin-5-yl)methylamino]propanoate
Also Known As: Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1, beta-Alanine, N-((2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-21H,23H-porphin-5-yl)methyl)-, methyl ester, methyl 3-[(2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-23,24-dihydroporphyrin-5-yl)methylamino]propanoate
| Molecular Formula | C37H47N5O2 |
|---|---|
| Molecular Weight | 593.37 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 95.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 593.373 |
| Heavy Atoms | 44 |
| Complexity | 934.0 |
Chemical Identifiers
| CAS Number | 69804-55-3 |
|---|---|
| SMILES | CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C(=C5C(=C(C(=N5)C=C1N2)C)CC)CNCCC(=O)OC)C)CC)C)CC)C |
| InChIKey | FSPZJAGSOOAWSH-UHFFFAOYSA-N |
Product Overview
Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1 (CAS 69804-55-3), with molecular formula C37H47N5O2 and molecular weight 593.37 g/mol. IUPAC: methyl 3-[(2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-23,24-dihydroporphyrin-5-yl)methylamino]propanoate.
Chemical Property Profile of Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1
Property Insights of Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1
The XLogP value of 5.9 indicates that Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1. Following Lipinski's Rule of Five, Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1?
The CAS number of Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1 is 69804-55-3.
What is the molecular formula of Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1?
The molecular formula of Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1 is C37H47N5O2.
What is the molecular weight of Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1?
The molecular weight of Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1 is 593.37 g/mol.
Where can I buy Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1?
You can request a quote for Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1?
Yes, KEHONG BIO provides custom synthesis services for Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.