TL;DR: Bmy 25551 (CAS 105139-98-8) is a chemical compound with molecular formula C17H21N3O7 and molecular weight 379.13794 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(4S)-11-(2-hydroxyethoxy)-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: Bmy 25551, 7-(2-Hydroxyethoxy)mitosane, 6-(2-Hydroxyethoxy-6-deaminomitomycin C), [6-(2-Hydroxyethoxy)-8a-methoxy-5-methyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazireno[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl hydrogen carbonimidate, [(1aS)-6-(2-Hydroxyethoxy)-8a-methoxy-5-methyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazirino[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl hydrogen carbonimidate
| Molecular Formula | C17H21N3O7 |
| Molecular Weight | 379.13794 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 150.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 379.13794 Da |
| Heavy Atoms | 27 |
| Complexity | 804.0 |
| SMILES | CC1=C(C(=O)C2=C(C1=O)N3C[C@H]4C(C3(C2COC(=O)N)OC)N4)OCCO |
| InChIKey | YJHYHDSHHWKEIS-LHRDQQHYSA-N |
The XLogP value of -0.4 indicates that Bmy 25551 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 150.0 Ų indicates high polarity, suggesting Bmy 25551 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bmy 25551 has 3 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 Bmy 25551 is 105139-98-8.
The molecular formula of Bmy 25551 is C17H21N3O7.
The molecular weight of Bmy 25551 is 379.13794 g/mol.
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