AC1LD5S0
methyl 5-[(8-morpholin-4-yl-13-oxo-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),15-pentaen-14-yl)methyl]furan-2-carboxylate
Also Known As: NCGC00020236-01|NCGC00020236-02|methyl 5-((5-morpholino-8-oxo-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-9(8H)-yl)methyl)furan-2-carboxylate|methyl 5-{[5-(morpholin-4-yl)-8-oxo-1,3,4,8-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-9(2H)-yl]methyl}furan-2-carboxylate
| Molecular Formula | C24H24N4O5S |
|---|---|
| Molecular Weight | 480.14673 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 480.14673 |
| Monoisotopic Mass | 480.14673 |
| Heavy Atoms | 34 |
| Complexity | 823.0 |
Chemical Identifiers
| CAS Number | 799795-08-7 |
|---|---|
| SMILES | COC(=O)C1=CC=C(O1)CN2C=NC3=C(C2=O)SC4=C3C5=C(CCCC5)C(=N4)N6CCOCC6 |
| InChIKey | DCNAPIBIORXXSU-UHFFFAOYSA-N |
Product Overview
AC1LD5S0 (CAS 799795-08-7), with molecular formula C24H24N4O5S and molecular weight 480.14673 g/mol. IUPAC: methyl 5-[(8-morpholin-4-yl-13-oxo-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),15-pentaen-14-yl)methyl]furan-2-carboxylate.
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