Home Carboxys Pyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxylicacid, 1,4-dihydro-1-(3-methoxypropyl)-4-oxo-

Pyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxylicacid, 1,4-dihydro-1-(3-methoxypropyl)-4-oxo-

CAS No.:
1086386-77-7
Catalog Number:
AG0083E8
Molecular Formula:
C15H15N3O4
Molecular Weight:
301.2973
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Product Description
Catalog Number:
AG0083E8
Chemical Name:
Pyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxylicacid, 1,4-dihydro-1-(3-methoxypropyl)-4-oxo-
CAS Number:
1086386-77-7
Molecular Formula:
C15H15N3O4
Molecular Weight:
301.2973
MDL Number:
MFCD11655653
IUPAC Name:
6-(3-methoxypropyl)-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxylic acid
InChI:
InChI=1S/C15H15N3O4/c1-22-8-4-7-17-11(15(20)21)9-10-13(17)16-12-5-2-3-6-18(12)14(10)19/h2-3,5-6,9H,4,7-8H2,1H3,(H,20,21)
InChI Key:
ZSXWKGKZYAJEAX-UHFFFAOYSA-N
SMILES:
COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)O
Properties
Complexity:
569  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.106g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
301.302g/mol
Monoisotopic Mass:
301.106g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties