TL;DR: Ethyl 4-(1,2,3-trihydrocyclopenta[2,1-b]quinolin-9-ylamino)benzoate, chloride (CAS 1043468-21-8) is a chemical compound with molecular formula C21H21ClN2O2 and molecular weight 368.12915 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-(2,3-dihydro-1H-cyclopenta[b]quinolin-9-ylamino)benzoate;hydrochloride
Also Known As: ethyl 4-((2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)amino)benzoate hydrochloride, ethyl 4-(1,2,3-trihydrocyclopenta[2,1-b]quinolin-9-ylamino)benzoate, chloride, ethyl 4-(2,3-dihydro-1H-cyclopenta[b]quinolin-9-ylamino)benzoate hydrochloride
| Molecular Formula | C21H21ClN2O2 |
| Molecular Weight | 368.12915 g/mol |
| XLogP | 5.0656 |
| Topological Polar Surface Area (TPSA) | 51.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.12915 Da |
| Heavy Atoms | 26 |
| Complexity | 461.0 |
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC2=C3CCCC3=NC4=CC=CC=C42.Cl |
| InChIKey | DVDYABSJZVNXRV-UHFFFAOYSA-N |
The XLogP value of 5.0656 indicates that Ethyl 4-(1,2,3-trihydrocyclopenta[2,1-b]quinolin-9-ylamino)benzoate, chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, Ethyl 4-(1,2,3-trihydrocyclopenta[2,1-b]quinolin-9-ylamino)benzoate, chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-(1,2,3-trihydrocyclopenta[2,1-b]quinolin-9-ylamino)benzoate, chloride has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Ethyl 4-(1,2,3-trihydrocyclopenta[2,1-b]quinolin-9-ylamino)benzoate, chloride is 1043468-21-8.
The molecular formula of Ethyl 4-(1,2,3-trihydrocyclopenta[2,1-b]quinolin-9-ylamino)benzoate, chloride is C21H21ClN2O2.
The molecular weight of Ethyl 4-(1,2,3-trihydrocyclopenta[2,1-b]quinolin-9-ylamino)benzoate, chloride is 368.12915 g/mol.
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