TL;DR: 2-[bis[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]amino]acetic acid (CAS 156939-63-8) is a chemical compound with molecular formula C36H35N3O6 and molecular weight 605.25256 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[bis[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]amino]acetic acid
Also Known As: NCI60_026503, 2-[bis[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]amino]acetic acid, (Bis(2-(((9H-fluoren-9-ylmethoxy)carbonyl)amino)ethyl)amino)acetic acid, N,N-Bis[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)ethyl]glycine, 1-(9H-Fluoren-9-ylmethyl) 5-(carboxymethyl)-11-(9H-fluoren-9-yl)-9-oxo-10-oxa-2,5,8-triazaundecanoate
| Molecular Formula | C36H35N3O6 |
| Molecular Weight | 605.25256 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 117.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 605.25256 Da |
| Heavy Atoms | 45 |
| Complexity | 895.0 |
| SMILES | C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCN(CCNC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46)CC(=O)O |
| InChIKey | VOAULNVCTYOJJN-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 2-[bis[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]amino]acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[bis[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]amino]acetic acid. Following Lipinski's Rule of Five, 2-[bis[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]amino]acetic acid has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-[bis[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]amino]acetic acid is 156939-63-8.
The molecular formula of 2-[bis[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]amino]acetic acid is C36H35N3O6.
The molecular weight of 2-[bis[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]amino]acetic acid is 605.25256 g/mol.
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