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Details

Stereochemistry ACHIRAL
Molecular Formula C17H16N6.2ClH
Molecular Weight 377.271
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-((4-AMINOPHENYL)METHYL)-7H-PYRROLO(3,2-F)QUINAZOLINE-1,3-DIAMINE DIHYDROCHLORIDE

SMILES

Cl.Cl.NC1=CC=C(CN2C=CC3=C2C=CC4=C3C(N)=NC(N)=N4)C=C1

InChI

InChIKey=UOORVXIQCDJQPV-UHFFFAOYSA-N
InChI=1S/C17H16N6.2ClH/c18-11-3-1-10(2-4-11)9-23-8-7-12-14(23)6-5-13-15(12)16(19)22-17(20)21-13;;/h1-8H,9,18H2,(H4,19,20,21,22);2*1H

HIDE SMILES / InChI

Molecular Formula C17H16N6
Molecular Weight 304.3491
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 Sat Dec 16 12:42:25 GMT 2023
Edited
by admin
on Sat Dec 16 12:42:25 GMT 2023
Record UNII
5QOG96Q7R2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-((4-AMINOPHENYL)METHYL)-7H-PYRROLO(3,2-F)QUINAZOLINE-1,3-DIAMINE DIHYDROCHLORIDE
Systematic Name English
NSC-309401
Code English
7H-PYRROLO(3,2-F)QUINAZOLINE-1,3-DIAMINE, 7-((4-AMINOPHENYL)METHYL)-, HYDROCHLORIDE (1:2)
Systematic Name English
7H-PYRROLO(3,2-F)QUINAZOLINE-1,3-DIAMINE, 7-((4-AMINOPHENYL)METHYL)-, DIHYDROCHLORIDE
Systematic Name English
Code System Code Type Description
NSC
309401
Created by admin on Sat Dec 16 12:42:25 GMT 2023 , Edited by admin on Sat Dec 16 12:42:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID90998881
Created by admin on Sat Dec 16 12:42:25 GMT 2023 , Edited by admin on Sat Dec 16 12:42:25 GMT 2023
PRIMARY
PUBCHEM
131634014
Created by admin on Sat Dec 16 12:42:25 GMT 2023 , Edited by admin on Sat Dec 16 12:42:25 GMT 2023
PRIMARY PUBCHEM
CAS
77681-42-6
Created by admin on Sat Dec 16 12:42:25 GMT 2023 , Edited by admin on Sat Dec 16 12:42:25 GMT 2023
PRIMARY
FDA UNII
5QOG96Q7R2
Created by admin on Sat Dec 16 12:42:25 GMT 2023 , Edited by admin on Sat Dec 16 12:42:25 GMT 2023
PRIMARY
Related Record Type Details
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