(4-METHYLPHENYL)METHYL 4'-(4-(((DIAMINOMETHYLIDENE)AMINO)METHYL)BENZOYLOXY)-(1,1'-BIPHENYL)-4-CARBOXYLATE HYDROCHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C30H27N3O4.ClH
Molecular Weight	530.014
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (4-METHYLPHENYL)METHYL 4'-(4-(((DIAMINOMETHYLIDENE)AMINO)METHYL)BENZOYLOXY)-(1,1'-BIPHENYL)-4-CARBOXYLATE HYDROCHLORIDE

Structure Search

SMILES

Cl.CC1=CC=C(COC(=O)C2=CC=C(C=C2)C3=CC=C(OC(=O)C4=CC=C(CNC(N)=N)C=C4)C=C3)C=C1

InChI

InChIKey=RZRXGTXLHKPOFX-UHFFFAOYSA-N

InChI=1S/C30H27N3O4.ClH/c1-20-2-4-22(5-3-20)19-36-28(34)25-12-10-23(11-13-25)24-14-16-27(17-15-24)37-29(35)26-8-6-21(7-9-26)18-33-30(31)32;/h2-17H,18-19H2,1H3,(H4,31,32,33);1H

HIDE SMILES / InChI

Molecular Formula	C30H27N3O4
Molecular Weight	493.5531
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 `Mon Mar 31 23:18:08 GMT 2025` Edited by `admin` on `Mon Mar 31 23:18:08 GMT 2025`
Record UNII	5P2E999225
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NE-2001

Preferred Name

English

(4-METHYLPHENYL)METHYL 4'-(4-(((DIAMINOMETHYLIDENE)AMINO)METHYL)BENZOYLOXY)-(1,1'-BIPHENYL)-4-CARBOXYLATE HYDROCHLORIDE

Systematic Name

English

(1,1'-BIPHENYL)-4-CARBOXYLIC ACID, 4'-((4-(((AMINOIMINOMETHYL)AMINO)METHYL)BENZOYL)OXY)-, (4-METHYLPHENYL)METHYL ESTER, MONOHYDROCHLORIDE

Systematic Name

English

(1,1'-BIPHENYL)-4-CARBOXYLIC ACID, 4'-((4-(((AMINOIMINOMETHYL)AMINO)METHYL)BENZOYL)OXY)-, (4-METHYLPHENYL)METHYL ESTER, HYDROCHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

PUBCHEM

9936805

Created by admin on Mon Mar 31 23:18:08 GMT 2025 , Edited by admin on Mon Mar 31 23:18:08 GMT 2025

PRIMARY

CAS

508195-41-3

Created by admin on Mon Mar 31 23:18:08 GMT 2025 , Edited by admin on Mon Mar 31 23:18:08 GMT 2025

PRIMARY

FDA UNII

5P2E999225

Created by admin on Mon Mar 31 23:18:08 GMT 2025 , Edited by admin on Mon Mar 31 23:18:08 GMT 2025

PRIMARY

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					659ZY58DY5

(4-METHYLPHENYL)METHYL 4'-(4-(((DIAMINOMETHYLIDENE)AMINO)METHYL)BENZOYLOXY)-(1,1'-BIPHENYL)-4-CARBOXYLATE

PARENT -> SALT/SOLVATE

Amount:

Related Record Type Details


					659ZY58DY5

(4-METHYLPHENYL)METHYL 4'-(4-(((DIAMINOMETHYLIDENE)AMINO)METHYL)BENZOYLOXY)-(1,1'-BIPHENYL)-4-CARBOXYLATE

ACTIVE MOIETY