N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | D336-0503 |
| Compound Name: | N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide |
| Molecular Weight: | 451.59 |
| Molecular Formula: | C22 H17 N3 O2 S3 |
| Smiles: | C1CN(C(CSc2nc3ccc(cc3s2)NC(c2cccs2)=O)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 5.1512 |
| logD: | 5.1512 |
| logSw: | -5.2916 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.581 |
| InChI Key: | UMKQFCWJWCQZLX-UHFFFAOYSA-N |