AC1MNBD4
5-(4-chlorophenyl)sulfonyl-6-imino-7-(3-morpholin-4-ylpropyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
Also Known As: 3-[(4-chlorophenyl)sulfonyl]-2-imino-1-(3-morpholin-4-ylpropyl)-1,6-dihydropyr idino[1,2-a]pyridino[2,3-d]pyrimidin-5-one|3-((4-chlorophenyl)sulfonyl)-2-imino-1-(3-morpholinopropyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one|3-[(4-chlorophenyl)sulfonyl]-2-imino-1-[3-(morpholin-4-yl)propyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
| Molecular Formula | C24H24ClN5O4S |
|---|---|
| Molecular Weight | 513.1238 g/mol |
| LogP | 2.33717 |
| Topological Polar Surface Area | 109.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 513.1238 |
| Monoisotopic Mass | 513.1238 |
| Heavy Atoms | 35 |
| Complexity | 1624.6078 |
Chemical Identifiers
| CAS Number | 579446-39-2 |
|---|---|
| SMILES | C1COCCN1CCCN2C3=C(C=C(C2=N)S(=O)(=O)C4=CC=C(C=C4)Cl)C(=O)N5C=CC=CC5=N3 |
Product Overview
AC1MNBD4 (CAS 579446-39-2), with molecular formula C24H24ClN5O4S and molecular weight 513.1238 g/mol. IUPAC: 5-(4-chlorophenyl)sulfonyl-6-imino-7-(3-morpholin-4-ylpropyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one.
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