N-(2-{[2-(4-bromoanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(naphthalen-1-yl)acetamide
Chemical Structure Depiction of
N-(2-{[2-(4-bromoanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(naphthalen-1-yl)acetamide
N-(2-{[2-(4-bromoanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(naphthalen-1-yl)acetamide
Compound characteristics
| Compound ID: | 8009-3082 |
| Compound Name: | N-(2-{[2-(4-bromoanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(naphthalen-1-yl)acetamide |
| Molecular Weight: | 562.51 |
| Molecular Formula: | C27 H20 Br N3 O2 S2 |
| Smiles: | C(C(Nc1ccc2c(c1)sc(n2)SCC(Nc1ccc(cc1)[Br])=O)=O)c1cccc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 7.158 |
| logD: | 7.1579 |
| logSw: | -7.1609 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.804 |
| InChI Key: | RIHQWBTXKKLZRE-UHFFFAOYSA-N |