C22H15BrN4O4S
5-(4-bromophenyl)sulfonyl-7-(furan-2-ylmethyl)-6-imino-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
Also Known As: 3-brosyl-1-(2-furfuryl)-2-imino-dipyrido[1,2-d:3'',4''-f]pyrimidin-5-one|2-azanylidene-3-(4-bromophenyl)sulfonyl-1-(furan-2-ylmethyl)dipyrido[1,2-d:3'',4''-f]pyrimidin-5-one|3-((4-bromophenyl)sulfonyl)-1-(furan-2-ylmethyl)-2-imino-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one|3-(4-bromophenyl)sulfonyl-1-(2-furanylmethyl)-2-imino-5-dipyrido[1,2-d:3'',4''-f]pyrimidinone|3-(4-bromophenyl)sulfonyl-1-(furan-2-ylmethyl)-2-iminodipyrido[1,2-d:3'',4''-f]pyrimidin-5-one|3-[(4-bromophenyl)sulfonyl]-1-(furan-2-ylmethyl)-2-imino-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
| Molecular Formula | C22H15BrN4O4S |
|---|---|
| Molecular Weight | 509.99973 g/mol |
| LogP | 3.36527 |
| Topological Polar Surface Area | 110.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 509.99973 |
| Monoisotopic Mass | 509.99973 |
| Heavy Atoms | 32 |
| Complexity | 1704.0475 |
Chemical Identifiers
| CAS Number | 577984-78-2 |
|---|---|
| SMILES | C1=CC2=NC3=C(C=C(C(=N)N3CC4=CC=CO4)S(=O)(=O)C5=CC=C(C=C5)Br)C(=O)N2C=C1 |
Product Overview
C22H15BrN4O4S (CAS 577984-78-2), with molecular formula C22H15BrN4O4S and molecular weight 509.99973 g/mol. IUPAC: 5-(4-bromophenyl)sulfonyl-7-(furan-2-ylmethyl)-6-imino-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one.