CAS
96250-35-0 Purity
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96250-35-0 Purity
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Deacetyl-O-demethyl diltiazem hydrochloride
CAS
96252-32-3
Catalog Number
ACM96252323
Category
Other Products
Molecular Weight
394.92
Molecular Formula
C19H23ClN2O3S
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Specification
Synonyms
(2S,3S)-5-[2-(Dimethylamino)ethyl]-2,3-dihydro-3-hydroxy-2-(4-hydroxyphenyl)-1,5-benzothiazepin-4(5H)-one Hydrochloride; Deacetyl-O-demethyl-d-diltiazem Hydrochloride; Deacetyl-O-demethyldiltiazem Hydrochloride;
IUPAC Name
(3S)-5-[2-(dimethylamino)ethyl]-3-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one;hydrochloride
InChI Key
NPMHEOKYIXUNBP-XRVQSCEISA-N
Appearance
White Solid
Exact Mass
394.11200
H-Bond Acceptor
5
H-Bond Donor
3
What is the molecular formula of Deacetyl-O-demethyl diltiazem hydrochloride?
The molecular formula of Deacetyl-O-demethyl diltiazem hydrochloride is C19H23ClN2O3S.
What is the molecular weight of Deacetyl-O-demethyl diltiazem hydrochloride?
The molecular weight of Deacetyl-O-demethyl diltiazem hydrochloride is 394.9 g/mol.
What are the synonyms of Deacetyl-O-demethyl diltiazem hydrochloride?
Some synonyms of Deacetyl-O-demethyl diltiazem hydrochloride are 40602-08-2, 96252-32-3, and DTXSID70961013.
What is the parent compound of Deacetyl-O-demethyl diltiazem hydrochloride?
The parent compound of Deacetyl-O-demethyl diltiazem hydrochloride is CID 218445, which has a similar chemical structure.
What is the IUPAC name of Deacetyl-O-demethyl diltiazem hydrochloride?
The IUPAC name of Deacetyl-O-demethyl diltiazem hydrochloride is 5-[2-(dimethylamino)ethyl]-3-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one;hydrochloride.
What is the InChIKey of Deacetyl-O-demethyl diltiazem hydrochloride?
The InChIKey of Deacetyl-O-demethyl diltiazem hydrochloride is NPMHEOKYIXUNBP-UHFFFAOYSA-N.
How many hydrogen bond donor counts does Deacetyl-O-demethyl diltiazem hydrochloride have?
Deacetyl-O-demethyl diltiazem hydrochloride has 3 hydrogen bond donor counts.
What is the exact mass of Deacetyl-O-demethyl diltiazem hydrochloride?
The exact mass of Deacetyl-O-demethyl diltiazem hydrochloride is 394.1117915 g/mol.
Is Deacetyl-O-demethyl diltiazem hydrochloride a canonicalized compound?
Yes, Deacetyl-O-demethyl diltiazem hydrochloride is a canonicalized compound.
What is the topological polar surface area of Deacetyl-O-demethyl diltiazem hydrochloride?
The topological polar surface area of Deacetyl-O-demethyl diltiazem hydrochloride is 89.3 Ų.
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