镍(II)中卟啉IX二甲酯
TL;DR: 镍(II)中卟啉IX二甲酯 (CAS 15892-09-8) is a chemical compound with molecular formula C36H40N4NiO4 and molecular weight 650.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
镍(II)中卟啉IX二甲酯
methyl 3-[8,13-diethyl-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoate;nickel(2+)
Also Known As: Nickel(II) mesoporphirin IX dimethyl ester, methyl 3-[7,12-diethyl-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethylporphyrin-21,23-diid-2-yl]propanoate; nickel(2+), methyl 3-[8,13-diethyl-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoate; nickel(2+), nickel(2+) 2,17-diethyl-8,12-bis(3-methoxy-3-oxopropyl)-3,7,13,18-tetramethylporphine-21,23-diide, Nickel, (dimethyl 7,12-diethyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoato(2-)-N21,N22,N23,N24)-, (SP-4-2)-
| Molecular Formula | C36H40N4NiO4 |
|---|---|
| Molecular Weight | 650.24 g/mol |
| LogP | 7.07994 |
| Topological Polar Surface Area | 80.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 650.2403 |
| Heavy Atoms | 45 |
| Complexity | 980.0 |
Chemical Identifiers
| CAS Number | 15892-09-8 |
|---|---|
| SMILES | CCC1=C(C2=NC1=CC3=C(C(=C([N-]3)C=C4C(=C(C(=CC5=NC(=C2)C(=C5C)CC)[N-]4)C)CCC(=O)OC)CCC(=O)OC)C)C.[Ni+2] |
| InChIKey | CJMFFQUNMOBZIS-UHFFFAOYSA-N |
Product Overview
镍(II)中卟啉IX二甲酯 (CAS 15892-09-8), with molecular formula C36H40N4NiO4 and molecular weight 650.24 g/mol. IUPAC: methyl 3-[8,13-diethyl-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoate;nickel(2+).
Chemical Property Profile of 镍(II)中卟啉IX二甲酯
Property Insights of 镍(II)中卟啉IX二甲酯
The XLogP value of 7.07994 indicates that 镍(II)中卟啉IX二甲酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 镍(II)中卟啉IX二甲酯. Following Lipinski's Rule of Five, 镍(II)中卟啉IX二甲酯 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 镍(II)中卟啉IX二甲酯?
The CAS number of 镍(II)中卟啉IX二甲酯 is 15892-09-8.
What is the molecular formula of 镍(II)中卟啉IX二甲酯?
The molecular formula of 镍(II)中卟啉IX二甲酯 is C36H40N4NiO4.
What is the molecular weight of 镍(II)中卟啉IX二甲酯?
The molecular weight of 镍(II)中卟啉IX二甲酯 is 650.24 g/mol.
Where can I buy 镍(II)中卟啉IX二甲酯?
You can request a quote for 镍(II)中卟啉IX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 镍(II)中卟啉IX二甲酯?
Yes, KEHONG BIO provides custom synthesis services for 镍(II)中卟啉IX二甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.