TL;DR: Antibiotic M83 (CAS 70343-57-6) is a chemical compound with molecular formula C21H22N4O6 and molecular weight 426.15393 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(7R,8S)-11-(4-hydroxyanilino)-7-methoxy-12-methyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate
Also Known As: Antibiotic M83, 7-N-(p-Hydroxyphenyl)-mitomycin C, N(6)-4-Hydroxyphenylmitomycin C, 7-N-(4-Hydroxyphenyl)mitomycin C, KW 2083
| Molecular Formula | C21H22N4O6 |
| Molecular Weight | 426.15393 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 153.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.15393 Da |
| Heavy Atoms | 31 |
| Complexity | 921.0 |
| SMILES | CC1=C(C(=O)C2=C(C1=O)N3CC4C([C@@]3([C@@H]2COC(=O)N)OC)N4)NC5=CC=C(C=C5)O |
| InChIKey | HNTGDFCASLOZEZ-QHLODZMVSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Antibiotic M83. The TPSA of 153.0 Ų indicates high polarity, suggesting Antibiotic M83 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Antibiotic M83 has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Antibiotic M83 is 70343-57-6.
The molecular formula of Antibiotic M83 is C21H22N4O6.
The molecular weight of Antibiotic M83 is 426.15393 g/mol.
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