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Structure

Ent-cinacalcet hydrochloride

CAS
694495-47-1
Catalog Number
ACM694495471
Category
Other Products
Molecular Weight
393.8729296
Molecular Formula
C22H23ClF3N

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Specification

Synonyms
ent-Cinacalcet Hydrochloride;(S)-N-(3-(3-(TrifluoroMethyl)phenyl)propyl)-1-
-(1-napthyl)ethylaMine Hydrochloride;(αS)-α-Methyl-N-[3-[3-(trifluoroMethyl)phenyl)propyl]-1-napthaleneMethanaMine Hydrochloride;(S)-Cinacalcet;(S)-Cinacalcet HCl;(S)-Cinacalcet HCl (ent-Cinacalcet HCl);1-NaphthaleneMethanaMine, α-Methyl-N-[3-[3-(trifluoroMethyl)phenyl]propyl]-, (αS)-;(alphaS)-alpha-Methyl-N-[3-[3-(trifluoromethyl)phenyl]propyl]-1-naphthalenemethanamine
Melting Point
179-181?C
What is the molecular formula of ent-cinacalcet hydrochloride?

The molecular formula of ent-cinacalcet hydrochloride is C22H23ClF3N.

What are the synonyms for ent-cinacalcet hydrochloride?

The synonyms for ent-cinacalcet hydrochloride include ent-Cinacalcet Hydrochloride, 1217809-88-5, and 694495-47-1.

What is the molecular weight of ent-cinacalcet hydrochloride?

The molecular weight of ent-cinacalcet hydrochloride is 393.9 g/mol.

What is the IUPAC name of ent-cinacalcet hydrochloride?

The IUPAC name of ent-cinacalcet hydrochloride is N-[(1S)-1-naphthalen-1-ylethyl]-3-[3-(trifluoromethyl)phenyl]propan-1-amine;hydrochloride.

What is the InChI of ent-cinacalcet hydrochloride?

The InChI of ent-cinacalcet hydrochloride is InChI=1S/C22H22F3N.ClH/c1-16(20-13-5-10-18-9-2-3-12-21(18)20)26-14-6-8-17-7-4-11-19(15-17)22(23,24)25;/h2-5,7,9-13,15-16,26H,6,8,14H2,1H3;1H/t16-;/m0./s1.

What is the InChIKey of ent-cinacalcet hydrochloride?

The InChIKey of ent-cinacalcet hydrochloride is QANQWUQOEJZMLL-NTISSMGPSA-N.

What is the canonical SMILES of ent-cinacalcet hydrochloride?

The canonical SMILES of ent-cinacalcet hydrochloride is CC(C1=CC=CC2=CC=CC=C21)NCCCC3=CC(=CC=C3)C(F)(F)F.Cl.

How many hydrogen bond donor counts are there in ent-cinacalcet hydrochloride?

There are 2 hydrogen bond donor counts in ent-cinacalcet hydrochloride.

How many hydrogen bond acceptor counts are there in ent-cinacalcet hydrochloride?

There are 4 hydrogen bond acceptor counts in ent-cinacalcet hydrochloride.

How many rotatable bond counts are there in ent-cinacalcet hydrochloride?

There are 6 rotatable bond counts in ent-cinacalcet hydrochloride.

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