N,N'-Bis(3-((phenylmethyl)amino)propyl)-1,7-heptanediamine

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H44N4
Molecular Weight	424.6651
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N,N'-Bis(3-((phenylmethyl)amino)propyl)-1,7-heptanediamine

Structure Search

SMILES

C(CCCNCCCNCC1=CC=CC=C1)CCCNCCCNCC2=CC=CC=C2

InChI

InChIKey=HZKTVSPJAMOCGF-UHFFFAOYSA-N

InChI=1S/C27H44N4/c1(2-10-18-28-20-12-22-30-24-26-14-6-4-7-15-26)3-11-19-29-21-13-23-31-25-27-16-8-5-9-17-27/h4-9,14-17,28-31H,1-3,10-13,18-25H2

HIDE SMILES / InChI

Molecular Formula	C27H44N4
Molecular Weight	424.6651
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 `Mon Mar 31 19:18:08 GMT 2025` Edited by `admin` on `Mon Mar 31 19:18:08 GMT 2025`
Record UNII	XWL44YH4RW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MDL 27695

Preferred Name

English

N,N'-Bis(3-((phenylmethyl)amino)propyl)-1,7-heptanediamine

Systematic Name

English

1,7-Heptanediamine, N,N'-bis(3-((phenylmethyl)amino)propyl)-

Systematic Name

English

1,7-Heptanediamine, N1,N7-bis[3-[(phenylmethyl)amino]propyl]-

Systematic Name

English

N1,N7-Bis[3-[(phenylmethyl)amino]propyl]-1,7-heptanediamine

Systematic Name

English

MDL-27695

Code

English

Code System Code Type Description

PUBCHEM

72453

Created by admin on Mon Mar 31 19:18:08 GMT 2025 , Edited by admin on Mon Mar 31 19:18:08 GMT 2025

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CAS

117654-71-4

Created by admin on Mon Mar 31 19:18:08 GMT 2025 , Edited by admin on Mon Mar 31 19:18:08 GMT 2025

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FDA UNII

XWL44YH4RW

Created by admin on Mon Mar 31 19:18:08 GMT 2025 , Edited by admin on Mon Mar 31 19:18:08 GMT 2025

PRIMARY

EPA CompTox

DTXSID50151859

Created by admin on Mon Mar 31 19:18:08 GMT 2025 , Edited by admin on Mon Mar 31 19:18:08 GMT 2025

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