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Details

Stereochemistry ACHIRAL
Molecular Formula C19H27N3O2.2ClH
Molecular Weight 402.358
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BAVISANT DIHYDROCHLORIDE ANHYDROUS

SMILES

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

InChI

InChIKey=PBVFXCXXVLBYKF-UHFFFAOYSA-N
InChI=1S/C19H27N3O2.2ClH/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

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

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:16:55 UTC 2023
Edited
by admin
on Fri Dec 15 19:16:55 UTC 2023
Record UNII
1B5560RN9F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BAVISANT DIHYDROCHLORIDE ANHYDROUS
Common Name English
METHANONE, (4-CYCLOPROPYL-1-PIPERAZINYL)(4-(4-MORPHOLINYLMETHYL)PHENYL)-, HYDROCHLORIDE (1:2)
Systematic Name English
(4-CYCLOPROPYLPIPERAZIN-1-YL)(4-(MORPHOLIN-4-YLMETHYL)PHENYL)METHANONE DIHYDROCHLORIDE
Systematic Name English
Bavisant dihydrochloride [WHO-DD]
Common Name English
Code System Code Type Description
CAS
929622-09-3
Created by admin on Fri Dec 15 19:16:55 UTC 2023 , Edited by admin on Fri Dec 15 19:16:55 UTC 2023
PRIMARY
SMS_ID
300000042549
Created by admin on Fri Dec 15 19:16:55 UTC 2023 , Edited by admin on Fri Dec 15 19:16:55 UTC 2023
PRIMARY
FDA UNII
1B5560RN9F
Created by admin on Fri Dec 15 19:16:55 UTC 2023 , Edited by admin on Fri Dec 15 19:16:55 UTC 2023
PRIMARY
PUBCHEM
66712477
Created by admin on Fri Dec 15 19:16:55 UTC 2023 , Edited by admin on Fri Dec 15 19:16:55 UTC 2023
PRIMARY
EPA CompTox
DTXSID00239212
Created by admin on Fri Dec 15 19:16:55 UTC 2023 , Edited by admin on Fri Dec 15 19:16:55 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
SOLVATE->ANHYDROUS