TL;DR: PYROPORPHYRIN DIMETHYL ESTER (CAS 10589-94-3) is a chemical compound with molecular formula C32H34N4O4 and molecular weight 538.258 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-[18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate
Also Known As: PYROPORPHYRIN DIMETHYL ESTER, Pyroporphyrindimethylester, DPIX dimethyl ester, deuteroporphyrin dimethyl ester, DEUTEROPORPHYRIN IX DIMETHYL ESTER
| Molecular Formula | C32H34N4O4 |
| Molecular Weight | 538.258 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 538.258 Da |
| Heavy Atoms | 40 |
| Complexity | 887.0 |
| SMILES | CC1=CC2=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 |
| InChIKey | CEPCOHFDZYMQHP-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that PYROPORPHYRIN DIMETHYL ESTER 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 PYROPORPHYRIN DIMETHYL ESTER. Following Lipinski's Rule of Five, PYROPORPHYRIN DIMETHYL ESTER has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of PYROPORPHYRIN DIMETHYL ESTER is 10589-94-3.
The molecular formula of PYROPORPHYRIN DIMETHYL ESTER is C32H34N4O4.
The molecular weight of PYROPORPHYRIN DIMETHYL ESTER is 538.258 g/mol.
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