Home Carboxys Pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid, 5-methyl-4-phenoxy-, ethyl ester

Pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid, 5-methyl-4-phenoxy-, ethyl ester

CAS No.:
1363380-63-5
Catalog Number:
AG0011NO
Molecular Formula:
C16H15N3O3
Molecular Weight:
297.3086
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Product Description
Catalog Number:
AG0011NO
Chemical Name:
Pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid, 5-methyl-4-phenoxy-, ethyl ester
CAS Number:
1363380-63-5
Molecular Formula:
C16H15N3O3
Molecular Weight:
297.3086
MDL Number:
MFCD22415213
IUPAC Name:
ethyl 5-methyl-4-phenoxypyrrolo[2,1-f][1,2,4]triazine-6-carboxylate
InChI:
InChI=1S/C16H15N3O3/c1-3-21-16(20)13-9-19-14(11(13)2)15(17-10-18-19)22-12-7-5-4-6-8-12/h4-10H,3H2,1-2H3
InChI Key:
QURNFBNWHYCIGF-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cn2c(c1C)c(ncn2)Oc1ccccc1
Properties
Complexity:
387  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.111g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.314g/mol
Monoisotopic Mass:
297.111g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
65.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties