N-(4-fluorophenyl)-2-({6-[(3-methoxyphenyl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-({6-[(3-methoxyphenyl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)acetamide
N-(4-fluorophenyl)-2-({6-[(3-methoxyphenyl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | D451-0936 |
| Compound Name: | N-(4-fluorophenyl)-2-({6-[(3-methoxyphenyl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 482.55 |
| Molecular Formula: | C23 H19 F N4 O3 S2 |
| Smiles: | COc1cccc(c1)NC(Nc1ccc2c(c1)sc(n2)SCC(Nc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8857 |
| logD: | 5.8856 |
| logSw: | -5.5066 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 72.045 |
| InChI Key: | WJVVGGINSUDSGP-UHFFFAOYSA-N |