{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decan-2-yl}(5-methylthiophen-2-yl)methanone
Chemical Structure Depiction of
{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decan-2-yl}(5-methylthiophen-2-yl)methanone
{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decan-2-yl}(5-methylthiophen-2-yl)methanone
Compound characteristics
| Compound ID: | SC66-0211 |
| Compound Name: | {4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decan-2-yl}(5-methylthiophen-2-yl)methanone |
| Molecular Weight: | 388.53 |
| Molecular Formula: | C20 H28 N4 O2 S |
| Smiles: | CC(C)Cn1cnnc1C1CN(CC12CCOCC2)C(c1ccc(C)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8063 |
| logD: | 2.8063 |
| logSw: | -3.0319 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.323 |
| InChI Key: | NFLLPMGZOBHGDC-INIZCTEOSA-N |