N-(2-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)naphthalene-1-carboxamide
Chemical Structure Depiction of
N-(2-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)naphthalene-1-carboxamide
N-(2-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)naphthalene-1-carboxamide
Compound characteristics
Compound ID: | 8009-5686 |
Compound Name: | N-(2-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)naphthalene-1-carboxamide |
Molecular Weight: | 529.64 |
Molecular Formula: | C28 H23 N3 O4 S2 |
Smiles: | COc1ccc(c(c1)NC(CSc1nc2ccc(cc2s1)NC(c1cccc2ccccc12)=O)=O)OC |
Stereo: | ACHIRAL |
logP: | 5.7748 |
logD: | 5.7744 |
logSw: | -6.6302 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 69.494 |
InChI Key: | NFYNGXMIKYHZPX-UHFFFAOYSA-N |