TL;DR: Iodoazidopotentidine (CAS 126632-02-8) is a chemical compound with molecular formula C26H32IN9O2 and molecular weight 629.17236 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-azido-N-[2-[[N-cyano-N'-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]carbamimidoyl]amino]ethyl]-3-iodobenzamide
Also Known As: Iodoazidopotentidine, I-Azpt, 4-azido-N-[2-[[N-cyano-N'-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]carbamimidoyl]amino]ethyl]-3-iodobenzamide, N-(2-(4-Azido-3-iodobenzamido)ethyl)-N'-cyano-N''-(3-(3-(1-piperidinylmethyl)phenoxy)propyl)guanidine, Benzamide, 4-azido-N-(2-(((cyanoamino)((3-(3-(1-piperidinylmethyl)phenoxy)propyl)amino)methylene)amino)ethyl)-3-iodo-
| Molecular Formula | C26H32IN9O2 |
| Molecular Weight | 629.17236 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 629.17236 Da |
| Heavy Atoms | 38 |
| Complexity | 851.0 |
| SMILES | C1CCN(CC1)CC2=CC(=CC=C2)OCCCN=C(NCCNC(=O)C3=CC(=C(C=C3)N=[N+]=[N-])I)NC#N |
| InChIKey | ZDEJFUULRAFTAI-UHFFFAOYSA-N |
The XLogP value of 4.8 indicates that Iodoazidopotentidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Iodoazidopotentidine. Following Lipinski's Rule of Five, Iodoazidopotentidine has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Iodoazidopotentidine is 126632-02-8.
The molecular formula of Iodoazidopotentidine is C26H32IN9O2.
The molecular weight of Iodoazidopotentidine is 629.17236 g/mol.
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