N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(morpholine-4-carbonyl)benzamide
Chemical Structure Depiction of
N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(morpholine-4-carbonyl)benzamide
N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(morpholine-4-carbonyl)benzamide
Compound characteristics
| Compound ID: | 8011-7048 |
| Compound Name: | N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(morpholine-4-carbonyl)benzamide |
| Molecular Weight: | 558.68 |
| Molecular Formula: | C29 H26 N4 O4 S2 |
| Smiles: | C1CN(C(CSc2nc3ccc(cc3s2)NC(c2ccccc2C(N2CCOCC2)=O)=O)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.0101 |
| logD: | 4.0099 |
| logSw: | -4.1781 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.119 |
| InChI Key: | DXYQKTGSDCBKLB-UHFFFAOYSA-N |