TL;DR: Hydroethidine (CAS 38483-26-0) is a chemical compound with molecular formula C21H21N3 and molecular weight 315.17355 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-ethyl-6-phenyl-5,6-dihydrobenzo[h]isoquinoline-4,8-diamine
Also Known As: Hydroethidine, Reduced ethidium, Dihydroethidium (Hydroethidium), 5,6-Dihydro-3,8-diamino-5-ethyl-6-phenylphenanthridine, 5-ethyl-6-phenyl-5,6-dihydrobenzo[h]isoquinoline-4,8-diamine
| Molecular Formula | C21H21N3 |
| Molecular Weight | 315.17355 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 64.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 315.17355 Da |
| Heavy Atoms | 24 |
| Complexity | 419.0 |
| SMILES | CCC1C(C2=C(C=CC(=C2)N)C3=CN=CC(=C13)N)C4=CC=CC=C4 |
| InChIKey | ZDWPSSBKIMIPMY-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that Hydroethidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydroethidine. Following Lipinski's Rule of Five, Hydroethidine has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Hydroethidine is 38483-26-0.
The molecular formula of Hydroethidine is C21H21N3.
The molecular weight of Hydroethidine is 315.17355 g/mol.
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