N-{2-[(2-anilino-2-oxoethyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-{2-[(2-anilino-2-oxoethyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide
N-{2-[(2-anilino-2-oxoethyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8007-6981 |
| Compound Name: | N-{2-[(2-anilino-2-oxoethyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 567.69 |
| Molecular Formula: | C24 H17 N5 O4 S4 |
| Smiles: | C(C(Nc1ccccc1)=O)Sc1nc2ccc(cc2s1)NC(CSc1nc2ccc(cc2s1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0191 |
| logD: | 6.019 |
| logSw: | -5.8506 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.538 |
| InChI Key: | KXNHSGMDBNXUKC-UHFFFAOYSA-N |