AC1M3JN1

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

Also Known As: AF-399/40756772|F1174-3037|methyl 4-[[2-[5-(5-methylfuran-2-yl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetyl]amino]benzoate|methyl 4-(2-((3-allyl-5-(5-methylfuran-2-yl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)thio)acetamido)benzoate|methyl 4-(2-{[5-(5-methylfuran-2-yl)-4-oxo-3-(prop-2-en-1-yl)-3H,4H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamido)benzoate|methyl 4-[({[3-allyl-5-(5-methyl-2-furyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate|methyl 4-{2-[5-(5-methyl(2-furyl))-4-oxo-3-prop-2-enyl-3-hydrothiopheno[2,3-d] pyrimidin-2-ylthio]acetylamino}benzoate

Molecular Formula	C24H21N3O5S2
Molecular Weight	495.09225 g/mol
LogP	4.72982
Topological Polar Surface Area	103.43 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	8
Exact Mass	495.09225
Monoisotopic Mass	495.09225
Heavy Atoms	34
Complexity	1433.3369

Chemical Identifiers

CAS Number	379236-63-2
SMILES	CC1=CC=C(O1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC=C(C=C4)C(=O)OC)CC=C