AC1NGW8I
2-methyl-4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylsulfanyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidine
Also Known As: 2-methyl-5-(thiophen-2-yl)-4-{5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-ylsulfanyl}thieno[2,3-d]pyrimidine|2-methyl-4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylsulfanyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidine
CAS: 852297-22-4
| Molecular Formula | C18H17N5S3 |
|---|---|
| Molecular Weight | 399.0646 g/mol |
| LogP | 5.19732 |
| Topological Polar Surface Area | 56.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 399.0646 |
| Monoisotopic Mass | 399.0646 |
| Heavy Atoms | 26 |
| Complexity | 1064.3263 |
Chemical Identifiers
| CAS Number | 852297-22-4 |
|---|---|
| SMILES | CC1=NC2=C(C(=CS2)C3=CC=CS3)C(=N1)SC4=NN=C5N4CCCCC5 |
Product Overview
AC1NGW8I (CAS 852297-22-4), with molecular formula C18H17N5S3 and molecular weight 399.0646 g/mol. IUPAC: 2-methyl-4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylsulfanyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidine.
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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