C13H10N4S — CID 704624
N-pyridin-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine (PubChem CID 704624) has the molecular formula C13H10N4S and a molecular weight of 254.32 g/mol. Its IUPAC name is N-pyridin-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine.
| Compound Name | N-pyridin-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine |
|---|---|
| PubChem CID | 704624 |
| Molecular Formula | C13H10N4S |
| Molecular Weight | 254.32 g/mol |
| Exact Mass | 254.06 |
| IUPAC Name | N-pyridin-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine |
| SMILES | c1ccc(Nc2nc(-c3cccnc3)cs2)nc1 |
| InChI | InChI=1S/C13H10N4S/c1-2-7-15-12(5-1)17-13-16-11(9-18-13)10-4-3-6-14-8-10/h1-9H,(H,15,16,17) |
| InChIKey | YVFMRJIXHKPNTN-UHFFFAOYSA-N |
| XLogP | 3.34 |
| TPSA | 50.70 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 254.32 |
| LogP ≤ 5 | 3.34 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |