N-[6-(methanesulfonyl)-3-methyl-1,3-benzothiazol-2(3H)-ylidene]-5-nitrofuran-2-carboxamide
Chemical Structure Depiction of
N-[6-(methanesulfonyl)-3-methyl-1,3-benzothiazol-2(3H)-ylidene]-5-nitrofuran-2-carboxamide
N-[6-(methanesulfonyl)-3-methyl-1,3-benzothiazol-2(3H)-ylidene]-5-nitrofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4553-0799 |
| Compound Name: | N-[6-(methanesulfonyl)-3-methyl-1,3-benzothiazol-2(3H)-ylidene]-5-nitrofuran-2-carboxamide |
| Molecular Weight: | 381.38 |
| Molecular Formula: | C14 H11 N3 O6 S2 |
| Smiles: | CN1/C(=N/C(c2ccc([N+]([O-])=O)o2)=O)Sc2cc(ccc12)S(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2505 |
| logD: | 1.2505 |
| logSw: | -2.3349 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 97.705 |
| InChI Key: | PLUGGWGTJYSTKE-UHFFFAOYSA-N |