N-(2-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-(decyloxy)benzamide
Chemical Structure Depiction of
N-(2-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-(decyloxy)benzamide
N-(2-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-(decyloxy)benzamide
Compound characteristics
| Compound ID: | 8008-8582 |
| Compound Name: | N-(2-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-(decyloxy)benzamide |
| Molecular Weight: | 588.88 |
| Molecular Formula: | C35 H44 N2 O2 S2 |
| Smiles: | CCCCCCCCCCOc1ccc(cc1)C(Nc1ccc2c(c1)sc(n2)SCc1ccc(cc1)C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 11.7207 |
| logD: | 11.7204 |
| logSw: | -5.5376 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.557 |
| InChI Key: | NDYAOBJEODQECH-UHFFFAOYSA-N |