AC1N92XC
5-(naphthalen-2-ylmethylsulfanyl)-12-propyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
Also Known As: 2-((naphthalen-2-ylmethyl)thio)-6-propyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine|2-[(naphthalen-2-ylmethyl)sulfanyl]-6-propyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
CAS: 799778-33-9
| Molecular Formula | C23H23N3OS2 |
|---|---|
| Molecular Weight | 421.12827 g/mol |
| LogP | 5.9604 |
| Topological Polar Surface Area | 61.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.12827 |
| Monoisotopic Mass | 421.12827 |
| Heavy Atoms | 29 |
| Complexity | 1187.6476 |
Chemical Identifiers
| CAS Number | 799778-33-9 |
|---|---|
| SMILES | CCCC1CC2=C(CO1)SC3=NC(=NC(=C23)N)SCC4=CC5=CC=CC=C5C=C4 |
Product Overview
AC1N92XC (CAS 799778-33-9), with molecular formula C23H23N3OS2 and molecular weight 421.12827 g/mol. IUPAC: 5-(naphthalen-2-ylmethylsulfanyl)-12-propyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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