2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-1-phenylethan-1-one
Chemical Structure Depiction of
2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-1-phenylethan-1-one
2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-1-phenylethan-1-one
Compound characteristics
| Compound ID: | 8006-6527 |
| Compound Name: | 2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-1-phenylethan-1-one |
| Molecular Weight: | 330.38 |
| Molecular Formula: | C15 H10 N2 O3 S2 |
| Smiles: | C(C(c1ccccc1)=O)Sc1nc2ccc(cc2s1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1142 |
| logD: | 4.1142 |
| logSw: | -4.3732 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.677 |
| InChI Key: | RIUPCBPWZWFMFY-UHFFFAOYSA-N |