AC1MTWU1
N-(1,3-benzodioxol-5-ylmethyl)-7-butyl-6-imino-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-(1,3-benzodioxol-5-ylmethyl)-1-butyl-2-imino-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide|N-(benzo[d][1,3]dioxol-5-ylmethyl)-1-butyl-2-imino-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
CAS: 858754-87-7
| Molecular Formula | C24H23N5O4 |
|---|---|
| Molecular Weight | 445.17502 g/mol |
| LogP | 2.58747 |
| Topological Polar Surface Area | 110.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.17502 |
| Monoisotopic Mass | 445.17502 |
| Heavy Atoms | 33 |
| Complexity | 1505.0286 |
Chemical Identifiers
| CAS Number | 858754-87-7 |
|---|---|
| SMILES | CCCCN1C2=C(C=C(C1=N)C(=O)NCC3=CC4=C(C=C3)OCO4)C(=O)N5C=CC=CC5=N2 |
Product Overview
AC1MTWU1 (CAS 858754-87-7), with molecular formula C24H23N5O4 and molecular weight 445.17502 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-7-butyl-6-imino-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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