AC1MTVSR
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-imino-2-oxo-7-prop-2-enyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: 1-allyl-N~3~-(3,4-dimethoxyphenethyl)-2-imino-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide|1-allyl-N-(3,4-dimethoxyphenethyl)-2-imino-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide|1-ALLYL-N-[2-(3,4-DIMETHOXYPHENYL)ETHYL]-2-IMINO-5-OXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2',3'-D]PYRIMIDINE-3-CARBOXAMIDE|N-[2-(3,4-dimethoxyphenyl)ethyl]-2-imino-5-oxo-1-(prop-2-en-1-yl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
| Molecular Formula | C25H25N5O4 |
|---|---|
| Molecular Weight | 459.19064 g/mol |
| LogP | 2.30437 |
| Topological Polar Surface Area | 110.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 459.19064 |
| Monoisotopic Mass | 459.19064 |
| Heavy Atoms | 34 |
| Complexity | 1520.05 |
Chemical Identifiers
| CAS Number | 577986-56-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC(=O)C2=CC3=C(N=C4C=CC=CN4C3=O)N(C2=N)CC=C)OC |
Product Overview
AC1MTVSR (CAS 577986-56-2), with molecular formula C25H25N5O4 and molecular weight 459.19064 g/mol. IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-imino-2-oxo-7-prop-2-enyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.