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CAS Number: 1029-52-3
2-amino-6-benzyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(1H)-one

Structure

 2-amino-6-benzyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(1H)-one
Name: 2-amino-6-benzyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(1H)-one
Synonyms:
General Information
Product Number: 1029523

CAS Registry Number 1029-52-3
Name:
Pyrido[4,?3-?d]?pyrimidin-?4(3H)?-?one, 2-?amino-?5,?6,?7,?8-?tetrahydro-?6-?(phenylmethyl)?-
Pyrido[4,3-d]pyrimidin-4(1H)-one, 2-amino-5,6,7,8-tetrahydro-6-(phenylmethyl)- (9CI)
Pyrido[4,3-d]pyrimidin-4-ol, 2-amino-6-benzyl-5,6,7,8-tetrahydro- (7CI,8CI)

 

Chemical Formula: C14H16N4O
Exact Mass: 256.13
Molecular Weight: 256.30
m/z: 256.13 (100.0%), 257.14 (15.4%), 257.13 (1.5%), 258.14 (1.3%)

 

InChI:InChI=1S/C14H16N4O/c15-14-16-12-6-7-18(9-11(12)13(19)17-14)8-10-4-2-1-3-5-10/h1-5H,6-9H2,(H3,15,16,17,19)

InChI Key:LLTVQQOAWCNPMD-UHFFFAOYSA-N

Canonical SMILES:C1CN(CC2=C1NC(=NC2=O)N)CC3=CC=CC=C3

 

Thermal Properties Value Condition Note
Melting Point 269-270 °C   (2)CAS
Melting Point 190-195 °C   (1)CAS

Specification

98%
References
  1. (1) Benderitter, Pascal; Tetrahedron 2007, V63(50), P12465-12470 CAPLUS
  2. (2) FR M2798 1964 CAPLUS
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