HEXEDINE

Details

Stereochemistry	MIXED
Molecular Formula	C22H45N3
Molecular Weight	351.6128
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCC(CC)CN1CN2CN(CC(CC)CCCC)CC2(C)C1

InChI

InChIKey=MSJBLPVXRJMJSY-UHFFFAOYSA-N

InChI=1S/C22H45N3/c1-6-10-12-20(8-3)14-23-16-22(5)17-24(19-25(22)18-23)15-21(9-4)13-11-7-2/h20-21H,6-19H2,1-5H3

HIDE SMILES / InChI

Molecular Formula	C22H45N3
Molecular Weight	351.6128
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/7696545

Hexedine has been used as an antimicrobial agent and drug constituent. Information about the current use of this drug is not available.

Approval Year

PubMed

Title	Date	PubMed
The nitrosation of hexetidine and hexedine: characterization of the major nitrosamine from common antimicrobial agents.	1994 Nov-Dec	7696545

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:19:06 UTC 2023` Edited by `admin` on `Fri Dec 15 15:19:06 UTC 2023`
Record UNII	LRE2528Y9E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

HEXEDINE

Official Name

English

hexedine [INN]

Common Name

English

HEXETIDINE IMPURITY C [EP IMPURITY]

Common Name

English

W-4701

Code

English

NSC-356715

Code

English

HEXEDINE [MI]

Common Name

English

W 4701

Code

English

HEXEDINE [USAN]

Common Name

English

STERISOL

Brand Name

English

1H-IMIDAZO(1,5-C)IMIDAZOLE, 2,6-BIS(2-ETHYLHEXYL)HEXAHYDRO-7A-METHYL-

Common Name

English

2,6-Bis(2-ethylhexyl)-hexahydro-7a-methyl-1H-imidazo[1,5-c]imidazole

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C28394