5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-[4-(propan-2-yl)benzene-1-sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-[4-(propan-2-yl)benzene-1-sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-[4-(propan-2-yl)benzene-1-sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | E565-0997 |
| Compound Name: | 5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-[4-(propan-2-yl)benzene-1-sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 499.61 |
| Molecular Formula: | C23 H25 N5 O4 S2 |
| Smiles: | CC(C)c1ccc(cc1)S(c1c2nc(c3c(ccs3)n2nn1)N1CCC2(CC1)OCCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5168 |
| logD: | 4.5168 |
| logSw: | -4.2376 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.583 |
| InChI Key: | BZHKNWBHWQFFAQ-UHFFFAOYSA-N |