N-(2-{[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(2-{[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
N-(2-{[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
Compound characteristics
Compound ID: | D336-2136 |
Compound Name: | N-(2-{[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide |
Molecular Weight: | 443.54 |
Molecular Formula: | C20 H14 F N3 O2 S3 |
Smiles: | C(C(Nc1ccccc1F)=O)Sc1nc2ccc(cc2s1)NC(c1cccs1)=O |
Stereo: | ACHIRAL |
logP: | 4.8323 |
logD: | 4.8322 |
logSw: | -4.8202 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 55.609 |
InChI Key: | UAMDBVAWIRQBLW-UHFFFAOYSA-N |