C11H11ClN2OS — CID 117250297
1-chloro-3-(thiolan-3-yl)imidazo[1,5-a]pyridin-5-ol (PubChem CID 117250297) has the molecular formula C11H11ClN2OS and a molecular weight of 254.74 g/mol. Its IUPAC name is 1-chloro-3-(thiolan-3-yl)imidazo[1,5-a]pyridin-5-ol.
| Compound Name | 1-chloro-3-(thiolan-3-yl)imidazo[1,5-a]pyridin-5-ol |
|---|---|
| PubChem CID | 117250297 |
| Molecular Formula | C11H11ClN2OS |
| Molecular Weight | 254.74 g/mol |
| Exact Mass | 254.03 |
| IUPAC Name | 1-chloro-3-(thiolan-3-yl)imidazo[1,5-a]pyridin-5-ol |
| SMILES | Oc1cccc2c(Cl)nc(C3CCSC3)n12 |
| InChI | InChI=1S/C11H11ClN2OS/c12-10-8-2-1-3-9(15)14(8)11(13-10)7-4-5-16-6-7/h1-3,7,15H,4-6H2 |
| InChIKey | OKFOCSWKIPTKRJ-UHFFFAOYSA-N |
| XLogP | 2.91 |
| TPSA | 37.53 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 16 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 254.74 |
| LogP ≤ 5 | 2.91 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |