{1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidin-4-yl}(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone
Chemical Structure Depiction of
{1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidin-4-yl}(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone
{1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidin-4-yl}(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone
Compound characteristics
| Compound ID: | C857-2034 |
| Compound Name: | {1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidin-4-yl}(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone |
| Molecular Weight: | 431.56 |
| Molecular Formula: | C21 H29 N5 O3 S |
| Smiles: | Cc1ccc(C)n1c1nnc(N2CCC(CC2)C(N2CCC3(CC2)OCCO3)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.0247 |
| logD: | 2.0247 |
| logSw: | -2.2283 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.799 |
| InChI Key: | JHONMELRRSHGCT-UHFFFAOYSA-N |