AC1LYCAD
3-phenyl-2-prop-2-ynylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: Oprea1_620957|Oprea1_661670|2-Nitro-|A-toluenesulfonyl chloride|BAS 01258300|SDCCGSBI-0659430.P001|SR-01000454750-1|3-phenyl-2-(prop-2-yn-1-ylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one|F1086-0006|3-phenyl-2-prop-2-ynylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one|4-phenyl-5-(prop-2-yn-1-ylsulfanyl)-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one|3-phenyl-2-(prop-2-yn-1-ylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one|3-phenyl-2-prop-2-ynylthio-3,5,6,7,8-pentahydrobenzo[b]thiopheno[2,3-d]pyrimid in-4-one|3-PHENYL-2-(2-PROPYNYLSULFANYL)-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE
| Molecular Formula | C19H16N2OS2 |
|---|---|
| Molecular Weight | 352.0704 g/mol |
| LogP | 4.0513 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.0704 |
| Monoisotopic Mass | 352.0704 |
| Heavy Atoms | 24 |
| Complexity | 996.1092 |
Chemical Identifiers
| CAS Number | 249750-75-2 |
|---|---|
| SMILES | C#CCSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=CC=C4 |
Product Overview
AC1LYCAD (CAS 249750-75-2), with molecular formula C19H16N2OS2 and molecular weight 352.0704 g/mol. IUPAC: 3-phenyl-2-prop-2-ynylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.