AC1O2PB5

5-[(2E,4E)-5-(6-hydroxy-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)penta-2,4-dienylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Also Known As: CBDivE_001052|THK-265|J3.408.266I|5-[(2E,4E)-5-(6-hydroxy-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)penta-2,4-dienylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione|5-[5-(6-hydroxy-4-oxo-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-2,4-pentadien-1-ylidene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione|2-Thioxo-5-[5-(2-thioxo-4-oxo-6-hydroxy-1,2,3,4-tetrahydropyrimidine-5-yl)-2,4-pentadienylidene]-2,5-dihydropyrimidine-4,6(1H,3H)-dione|5-(2E,4E)-5-(6-hydroxy-4-oxo-2-thioxo-1,2,3,4-tetrahydroxy-5 pyrimidinyl)-2,4-pentadienylidene-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione|5-[(2E,4E)-5-(6-hydroxy-4-oxo-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-2,4-pentadienylidene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione|5-[5-(6-hydroxy-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-5-yl)penta-2,4-dien-1-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Molecular Formula	C13H10N4O4S2
Molecular Weight	350.01434 g/mol
LogP	0.16479
Topological Polar Surface Area	127.08 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	6
Rotatable Bonds	3
Exact Mass	350.01434
Monoisotopic Mass	350.01434
Heavy Atoms	23
Complexity	869.97095

Chemical Identifiers

CAS Number	147641-54-1
SMILES	C(=C/C=C1C(=O)NC(=S)NC1=O)\C=C\C2=C(NC(=S)NC2=O)O