N-(2-{[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)furan-2-carboxamide
Chemical Structure Depiction of
N-(2-{[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)furan-2-carboxamide
N-(2-{[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)furan-2-carboxamide
Compound characteristics
| Compound ID: | D336-2634 |
| Compound Name: | N-(2-{[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)furan-2-carboxamide |
| Molecular Weight: | 439.51 |
| Molecular Formula: | C21 H17 N3 O4 S2 |
| Smiles: | COc1ccc(cc1)NC(CSc1nc2ccc(cc2s1)NC(c1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3945 |
| logD: | 4.3943 |
| logSw: | -4.3581 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.411 |
| InChI Key: | WHLWYMXRGKXMLQ-UHFFFAOYSA-N |