TL;DR: 11H-Pyrido(3,2-a)carbazole-11-ethanamine, 3-chloro-N,N-dimethyl- (CAS 127040-51-1) is a chemical compound with molecular formula C19H18ClN3 and molecular weight 323.11893 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-chloropyrido[3,2-a]carbazol-11-yl)-N,N-dimethylethanamine
Also Known As: 11H-Pyrido(3,2-a)carbazole-11-ethanamine, 3-chloro-N,N-dimethyl-, 3-Chloro-11-(beta-dimethylaminoethyl)pyrido(3,2-a)carbazole, 3-Chloro-N,N-dimethyl-11H-pyrido(3,2-a)carbazole-11-ethanamine, AO-082/13829003, N-[2-(3-chloro-11H-pyrido[3,2-a]carbazol-11-yl)ethyl]-N,N-dimethylamine
| Molecular Formula | C19H18ClN3 |
| Molecular Weight | 323.11893 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 21.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.11893 Da |
| Heavy Atoms | 23 |
| Complexity | 415.0 |
| SMILES | CN(C)CCN1C2=CC=CC=C2C3=C1C4=C(C=C3)N=C(C=C4)Cl |
| InChIKey | TXLITCMTVMLYNV-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that 11H-Pyrido(3,2-a)carbazole-11-ethanamine, 3-chloro-N,N-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.1 Ų, 11H-Pyrido(3,2-a)carbazole-11-ethanamine, 3-chloro-N,N-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11H-Pyrido(3,2-a)carbazole-11-ethanamine, 3-chloro-N,N-dimethyl- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 11H-Pyrido(3,2-a)carbazole-11-ethanamine, 3-chloro-N,N-dimethyl- is 127040-51-1.
The molecular formula of 11H-Pyrido(3,2-a)carbazole-11-ethanamine, 3-chloro-N,N-dimethyl- is C19H18ClN3.
The molecular weight of 11H-Pyrido(3,2-a)carbazole-11-ethanamine, 3-chloro-N,N-dimethyl- is 323.11893 g/mol.
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