N-(2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-phenylprop-2-enamide
Chemical Structure Depiction of
N-(2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-phenylprop-2-enamide
N-(2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | 8008-5797 |
| Compound Name: | N-(2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-phenylprop-2-enamide |
| Molecular Weight: | 451.61 |
| Molecular Formula: | C24 H25 N3 O2 S2 |
| Smiles: | C1CCC(CC1)NC(CSc1nc2ccc(cc2s1)NC(/C=C/c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.717 |
| logD: | 5.717 |
| logSw: | -5.7288 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.123 |
| InChI Key: | ZNDCTHNUCLANPI-UHFFFAOYSA-N |