AC1NEMJG
5-(4-bromophenyl)sulfonyl-6-imino-7-(2-morpholin-4-ylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
Also Known As: 3-(4-Bromo-benzenesulfonyl)-2-imino-1-(2-morpholin-4-yl-ethyl)-1,2-dihydro-1,9,10a-triaza-anthracen-1 0-one|3-((4-bromophenyl)sulfonyl)-2-imino-1-(2-morpholinoethyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one|3-[(4-bromophenyl)sulfonyl]-2-imino-1-[2-(morpholin-4-yl)ethyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
| Molecular Formula | C23H22BrN5O4S |
|---|---|
| Molecular Weight | 543.0576 g/mol |
| LogP | 2.05617 |
| Topological Polar Surface Area | 109.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 543.0576 |
| Monoisotopic Mass | 543.0576 |
| Heavy Atoms | 34 |
| Complexity | 1607.2892 |
Chemical Identifiers
| CAS Number | 577762-94-8 |
|---|---|
| SMILES | C1COCCN1CCN2C3=C(C=C(C2=N)S(=O)(=O)C4=CC=C(C=C4)Br)C(=O)N5C=CC=CC5=N3 |
Product Overview
AC1NEMJG (CAS 577762-94-8), with molecular formula C23H22BrN5O4S and molecular weight 543.0576 g/mol. IUPAC: 5-(4-bromophenyl)sulfonyl-6-imino-7-(2-morpholin-4-ylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one.
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