N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)furan-2-carboxamide
Chemical Structure Depiction of
N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)furan-2-carboxamide
N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)furan-2-carboxamide
Compound characteristics
| Compound ID: | D336-0504 |
| Compound Name: | N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)furan-2-carboxamide |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C22 H17 N3 O3 S2 |
| Smiles: | C1CN(C(CSc2nc3ccc(cc3s2)NC(c2ccco2)=O)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.5112 |
| logD: | 4.511 |
| logSw: | -4.2954 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.141 |
| InChI Key: | NKRMDYWQNULXDE-UHFFFAOYSA-N |