909666-49-5 Purity
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Specification
The molecular formula is C17H17ClF3N3OS.
The molecular weight is 403.8 g/mol.
Synonyms include 909668-83-3, 4-[(5-chloro-2-thienyl)methyl]-1-([6-(trifluoromethyl)pyridin-3-yl]methyl)-1,4-diazepan-5-one, and more.
The InChIKey is PTEMVPBYMCJMFC-UHFFFAOYSA-N.
The compound has 7 hydrogen bond acceptor counts.
The topological polar surface area is 64.7 Ų.
The compound has 4 rotatable bond counts.
Yes, the compound is canonicalized.
The XLogP3-AA value is 3.
The compound was created on 2008-02-29 and last modified on 2023-12-30.