BAVISANT DIHYDROCHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H27N3O2.2ClH.H2O
Molecular Weight	420.374
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O.Cl.Cl.O=C(N1CCN(CC1)C2CC2)C3=CC=C(CN4CCOCC4)C=C3

InChI

InChIKey=BLFBQJUVAGIUBL-UHFFFAOYSA-N

InChI=1S/C19H27N3O2.2ClH.H2O/c23-19(22-9-7-21(8-10-22)18-5-6-18)17-3-1-16(2-4-17)15-20-11-13-24-14-12-20;;;/h1-4,18H,5-15H2;2*1H;1H2

HIDE SMILES / InChI

Molecular Formula	C19H27N3O2
Molecular Weight	329.4366
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:32:03 UTC 2023` Edited by `admin` on `Fri Dec 15 16:32:03 UTC 2023`
Record UNII	C1H7H5X3RE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BAVISANT DIHYDROCHLORIDE

Official Name

English

METHANONE, (4-CYCLOPROPYL-1-PIPERAZINYL)(4-(4-MORPHOLINYLMETHYL)PHENYL)-, HYDROCHLORIDE, HYDRATE (1:2:1)

Systematic Name

English

Bavisant dihydrochloride monohydrate [WHO-DD]

Common Name

English

(4-Cyclopropylpiperazin-1-yl)[4-(morpholin-4-ylmethyl)phenyl]methanone dihydrochloride monohydrate

Systematic Name

English

BEN-2001

Code

English

JNJ-31001074-AAC

Code

English

BAVISANT DIHYDROCHLORIDE MONOHYDRATE

Common Name

English

BAVISANT DIHYDROCHLORIDE [USAN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C47795