AC1LUPBM
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one
Also Known As: UPCMLD0ENAT5890590:001|3-allyl-2-(((3,5-dimethylisoxazol-4-yl)methyl)thio)-5-(p-tolyl)thieno[2,3-d]pyrimidin-4(3H)-one|AF-399/15336005|F1143-2116|2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one|2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}-5-(4-methylphenyl)-3-(prop-2-en-1-yl)-3H,4H-thieno[2,3-d]pyrimidin-4-one|3-allyl-2-{[(3,5-dimethyl-4-isoxazolyl)methyl]sulfanyl}-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C22H21N3O2S2 |
|---|---|
| Molecular Weight | 423.1075 g/mol |
| LogP | 5.51656 |
| Topological Polar Surface Area | 60.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 423.1075 |
| Monoisotopic Mass | 423.1075 |
| Heavy Atoms | 29 |
| Complexity | 1230.2825 |
Chemical Identifiers
| CAS Number | 379249-75-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC4=C(ON=C4C)C)CC=C |
Product Overview
AC1LUPBM (CAS 379249-75-9), with molecular formula C22H21N3O2S2 and molecular weight 423.1075 g/mol. IUPAC: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one.
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