AC1LWZ9Q

methyl 4-[[2-[5-(furan-2-yl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetyl]amino]benzoate

Also Known As: Oprea1_717848|AF-399/40850986|methyl 4-[({[5-(furan-2-yl)-4-oxo-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate|methyl 4-[({[3-allyl-5-(2-furyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate|methyl 4-[[2-[5-(furan-2-yl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetyl]amino]benzoate|methyl 4-[2-(5-(2-furyl)-4-oxo-3-prop-2-enyl-3-hydrothiopheno[2,3-d]pyrimidin- 2-ylthio)acetylamino]benzoate

Molecular Formula	C23H19N3O5S2
Molecular Weight	481.0766 g/mol
LogP	4.4214
Topological Polar Surface Area	103.43 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	8
Exact Mass	481.0766
Monoisotopic Mass	481.0766
Heavy Atoms	33
Complexity	1371.865

Chemical Identifiers

CAS Number	379237-10-2
SMILES	COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=CS3)C4=CC=CO4)C(=O)N2CC=C