3-[2-oxo-2-(thiophen-2-yl)ethyl]-1,2,3-benzotriazin-4(3H)-one
Chemical Structure Depiction of
3-[2-oxo-2-(thiophen-2-yl)ethyl]-1,2,3-benzotriazin-4(3H)-one
3-[2-oxo-2-(thiophen-2-yl)ethyl]-1,2,3-benzotriazin-4(3H)-one
Compound characteristics
| Compound ID: | 8017-5474 |
| Compound Name: | 3-[2-oxo-2-(thiophen-2-yl)ethyl]-1,2,3-benzotriazin-4(3H)-one |
| Molecular Weight: | 271.29 |
| Molecular Formula: | C13 H9 N3 O2 S |
| Smiles: | C(C(c1cccs1)=O)N1C(c2ccccc2N=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.309 |
| logD: | 2.309 |
| logSw: | -2.8921 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.198 |
| InChI Key: | YBRGDWKEWCMOND-UHFFFAOYSA-N |