TL;DR: N(alpha)-(2-Naphthylsulfonylglycyl)-4-guanidinomethylphenylalaninepiperidide (CAS 119777-12-7) is a chemical compound with molecular formula C28H34N6O4S and molecular weight 550.2362 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[3-[4-[(diaminomethylideneamino)methyl]phenyl]-1-oxo-1-piperidin-1-ylpropan-2-yl]-2-(naphthalen-2-ylsulfonylamino)acetamide
Also Known As: Nsggmpp, N(alpha)-(2-Naphthylsulfonylglycyl)-4-guanidinomethylphenylalaninepiperidide, N-[3-[4-[(diaminomethylideneamino)methyl]phenyl]-1-oxo-1-(1-piperidyl)propan-2-yl]-2-(naphthalen-2-ylsulfonylamino)acetamide, N-[3-[4-[(diaminomethylideneamino)methyl]phenyl]-1-oxo-1-piperidin-1-ylpropan-2-yl]-2-(naphthalen-2-ylsulfonylamino)acetamide, Acetamide, N-(1-((4-(((aminoiminomethyl)amino)methyl)phenyl)methyl)-2-oxo-2-(1-piperidinyl)ethyl)-2-((2-naphthalenylsulfonyl)amino)-
| Molecular Formula | C28H34N6O4S |
| Molecular Weight | 550.2362 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 168.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 550.2362 Da |
| Heavy Atoms | 39 |
| Complexity | 950.0 |
| SMILES | C1CCN(CC1)C(=O)C(CC2=CC=C(C=C2)CN=C(N)N)NC(=O)CNS(=O)(=O)C3=CC4=CC=CC=C4C=C3 |
| InChIKey | WMTPJYLLGLWCDT-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N(alpha)-(2-Naphthylsulfonylglycyl)-4-guanidinomethylphenylalaninepiperidide. The TPSA of 168.0 Ų indicates high polarity, suggesting N(alpha)-(2-Naphthylsulfonylglycyl)-4-guanidinomethylphenylalaninepiperidide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N(alpha)-(2-Naphthylsulfonylglycyl)-4-guanidinomethylphenylalaninepiperidide has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of N(alpha)-(2-Naphthylsulfonylglycyl)-4-guanidinomethylphenylalaninepiperidide is 119777-12-7.
The molecular formula of N(alpha)-(2-Naphthylsulfonylglycyl)-4-guanidinomethylphenylalaninepiperidide is C28H34N6O4S.
The molecular weight of N(alpha)-(2-Naphthylsulfonylglycyl)-4-guanidinomethylphenylalaninepiperidide is 550.2362 g/mol.
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