TL;DR: SK&F 107260 (CAS 158599-52-1) is a chemical compound with molecular formula C26H31N7O6S2 and molecular weight 601.17773 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(12S,18S)-18-[3-(diaminomethylideneamino)propyl]-19-methyl-11,14,17,20-tetraoxo-2,3-dithia-10,13,16,19-tetrazatricyclo[19.4.0.04,9]pentacosa-1(25),4,6,8,21,23-hexaen-12-yl]acetic acid
Also Known As: phenylmethyl 4-iodobenzoate, SK&F 107260, Skf 107260, SK&F-107260, KST-1A1772
| Molecular Formula | C26H31N7O6S2 |
| Molecular Weight | 601.17773 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 260.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 601.17773 Da |
| Heavy Atoms | 41 |
| Complexity | 995.0 |
| SMILES | CN1[C@H](C(=O)NCC(=O)N[C@H](C(=O)NC2=CC=CC=C2SSC3=CC=CC=C3C1=O)CC(=O)O)CCCN=C(N)N |
| InChIKey | YITSCMGHJOGUNC-ROUUACIJSA-N |
The XLogP value of -0.1 indicates that SK&F 107260 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 260.0 Ų indicates high polarity, suggesting SK&F 107260 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, SK&F 107260 has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of SK&F 107260 is 158599-52-1.
The molecular formula of SK&F 107260 is C26H31N7O6S2.
The molecular weight of SK&F 107260 is 601.17773 g/mol.
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