AC1N8VJA structure

AC1N8VJA

N-butyl-7-(furan-2-ylmethyl)-6-imino-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide

Also Known As: N-butyl-7-[(furan-2-yl)methyl]-6-imino-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide|N-butyl-1-(furan-2-ylmethyl)-2-imino-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide|N-butyl-1-(furan-2-ylmethyl)-2-imino-10-methyl-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide

CAS: 847161-75-5
Molecular Formula C22H23N5O3
Molecular Weight 405.18008 g/mol
LogP 2.60829
Topological Polar Surface Area 105.39 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 405.18008
Monoisotopic Mass 405.18008
Heavy Atoms 30
Complexity 1349.4591

Chemical Identifiers

CAS Number 847161-75-5
SMILES CCCCNC(=O)C1=CC2=C(N=C3C(=CC=CN3C2=O)C)N(C1=N)CC4=CC=CO4

Product Overview

AC1N8VJA (CAS 847161-75-5), with molecular formula C22H23N5O3 and molecular weight 405.18008 g/mol. IUPAC: N-butyl-7-(furan-2-ylmethyl)-6-imino-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.

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