TL;DR: (3-chloro-1-benzothiophen-2-yl)(2,2,4,6,7-pentamethyl-3,4-dihydroquinolin-1(2H)-yl)methanone (CAS 371220-82-5) is a chemical compound with molecular formula C23H24ClNOS and molecular weight 397.1267 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-chloro-1-benzothiophen-2-yl)-(2,2,4,6,7-pentamethyl-3,4-dihydroquinolin-1-yl)methanone
Also Known As: (3-chloro-1-benzothiophen-2-yl)(2,2,4,6,7-pentamethyl-3,4-dihydroquinolin-1(2H)-yl)methanone, (3-chloro-1-benzothiophen-2-yl)-(2,2,4,6,7-pentamethyl-3,4-dihydroquinolin-1-yl)methanone, 3-chlorobenzo[b]thiophen-2-yl 2,2,4,6,7-pentamethyl(1,2,3,4-tetrahydroquinolyl ) ketone, (3-chlorobenzo[b]thiophen-2-yl)(2,2,4,6,7-pentamethyl-3,4-dihydroquinolin-1(2H)-yl)methanone, 1-(3-CHLORO-1-BENZOTHIOPHENE-2-CARBONYL)-2,2,4,6,7-PENTAMETHYL-1,2,3,4-TETRAHYDROQUINOLINE
| Molecular Formula | C23H24ClNOS |
| Molecular Weight | 397.1267 g/mol |
| XLogP | 7.0 |
| Topological Polar Surface Area (TPSA) | 48.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 397.1267 Da |
| Heavy Atoms | 27 |
| Complexity | 581.0 |
| SMILES | CC1CC(N(C2=C1C=C(C(=C2)C)C)C(=O)C3=C(C4=CC=CC=C4S3)Cl)(C)C |
| InChIKey | YOWDSBQPFUCUPT-UHFFFAOYSA-N |
The XLogP value of 7.0 indicates that (3-chloro-1-benzothiophen-2-yl)(2,2,4,6,7-pentamethyl-3,4-dihydroquinolin-1(2H)-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.6 Ų, (3-chloro-1-benzothiophen-2-yl)(2,2,4,6,7-pentamethyl-3,4-dihydroquinolin-1(2H)-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-chloro-1-benzothiophen-2-yl)(2,2,4,6,7-pentamethyl-3,4-dihydroquinolin-1(2H)-yl)methanone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (3-chloro-1-benzothiophen-2-yl)(2,2,4,6,7-pentamethyl-3,4-dihydroquinolin-1(2H)-yl)methanone is 371220-82-5.
The molecular formula of (3-chloro-1-benzothiophen-2-yl)(2,2,4,6,7-pentamethyl-3,4-dihydroquinolin-1(2H)-yl)methanone is C23H24ClNOS.
The molecular weight of (3-chloro-1-benzothiophen-2-yl)(2,2,4,6,7-pentamethyl-3,4-dihydroquinolin-1(2H)-yl)methanone is 397.1267 g/mol.
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