N-(1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-(1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | K936-0238 |
| Compound Name: | N-(1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C24 H17 N3 O3 S |
| Smiles: | COc1ccc(cc1)N1C=C(C(Nc2nc3ccccc3s2)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 4.394 |
| logD: | 4.3902 |
| logSw: | -4.4903 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.151 |
| InChI Key: | ZSZBAHZXFAXPLB-UHFFFAOYSA-N |