5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-(pyrrolidin-1-yl)-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Chemical Structure Depiction of
5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-(pyrrolidin-1-yl)-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-(pyrrolidin-1-yl)-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Compound characteristics
| Compound ID: | F149-0893 |
| Compound Name: | 5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-(pyrrolidin-1-yl)-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one |
| Molecular Weight: | 391.45 |
| Molecular Formula: | C17 H21 N5 O4 S |
| Smiles: | C1CCN(C1)C1=NN2C(=CC(N=C2S1)=O)C(N1CCC2(CC1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6053 |
| logD: | -0.0184 |
| logSw: | -1.2523 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.464 |
| InChI Key: | CRSWICIJZOSGCQ-UHFFFAOYSA-N |