TL;DR: CID 29290 (CAS 802858-72-6) is a chemical compound with molecular formula C20H27ClN2S and molecular weight 362.15836 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(2-chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)sulfanyl]-N,N-diethylethanamine
Also Known As: 2-[(2-Chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)thio]-N,N-diethylethanamine, 2-[(2-Chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)sulfanyl]-N,N-diethylethan-1-amine, 2-[(2-chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)sulfanyl]-N,N-diethylethanamine
| Molecular Formula | C20H27ClN2S |
| Molecular Weight | 362.15836 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 41.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 362.15836 Da |
| Heavy Atoms | 24 |
| Complexity | 377.0 |
| SMILES | CCN(CC)CCSC1=C2CCCCCC2=NC3=C1C=C(C=C3)Cl |
| InChIKey | WVCJXVUCVOAKGK-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that CID 29290 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.4 Ų, CID 29290 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CID 29290 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of CID 29290 is 802858-72-6.
The molecular formula of CID 29290 is C20H27ClN2S.
The molecular weight of CID 29290 is 362.15836 g/mol.
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