4-(azepane-1-sulfonyl)-N-(4-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)benzamide
Chemical Structure Depiction of
4-(azepane-1-sulfonyl)-N-(4-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)benzamide
4-(azepane-1-sulfonyl)-N-(4-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)benzamide
Compound characteristics
| Compound ID: | C059-0109 |
| Compound Name: | 4-(azepane-1-sulfonyl)-N-(4-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)benzamide |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C22 H25 N3 O4 S2 |
| Smiles: | CN1/C(=N/C(c2ccc(cc2)S(N2CCCCCC2)(=O)=O)=O)Sc2cccc(c12)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7051 |
| logD: | 3.7051 |
| logSw: | -3.9676 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 66.126 |
| InChI Key: | CCONZRGQFZFTLE-UHFFFAOYSA-N |