Structure

1-[2-(4-Chlorophenoxy)ethyl]-4-([6-(trifluoromethyl)pyridin-3-yl]methyl)-1,4-diazepan-5-one

CAS
909659-29-6
Catalog Number
ACM909659296
Category
Other Products
Molecular Weight
427.8478496
Molecular Formula
C20H21ClF3N3O2

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Specification

Synonyms
1-[2-(4-CHLOROPHENOXY)ETHYL]-4-([6-(TRIFLUOROMETHYL)PYRIDIN-3-YL]METHYL)-1,4-DIAZEPAN-5-ONE
What is the molecular weight of the compound with the PubChem CID 24733015?

The molecular weight is 427.8 g/mol.

What is the IUPAC name of the compound with the PubChem CID 24733015?

The IUPAC name is 1-[2-(4-chlorophenoxy)ethyl]-4-[[6-(trifluoromethyl)pyridin-3-yl]methyl]-1,4-diazepan-5-one.

How many hydrogen bond donor counts are there in the compound with the PubChem CID 24733015?

There are 0 hydrogen bond donor counts.

What is the topological polar surface area of the compound with the PubChem CID 24733015?

The topological polar surface area is 45.7 Å2.

How many rotatable bond counts are there in the compound with the PubChem CID 24733015?

There are 6 rotatable bond counts.

Is the compound with the PubChem CID 24733015 canonicalized?

Yes, the compound is canonicalized.

What is the InChIKey of the compound with the PubChem CID 24733015?

The InChIKey is CAFDZUJKPBOQIG-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts are there in the compound with the PubChem CID 24733015?

There are 7 hydrogen bond acceptor counts.

What is the exact mass of the compound with the PubChem CID 24733015?

The exact mass is 427.1274391 g/mol.

How many heavy atoms are present in the compound with the PubChem CID 24733015?

There are 29 heavy atoms.

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