N-(2-methylphenyl)-2-{[6-(phenylcarbamamido)-1,3-benzothiazol-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-methylphenyl)-2-{[6-(phenylcarbamamido)-1,3-benzothiazol-2-yl]sulfanyl}acetamide
N-(2-methylphenyl)-2-{[6-(phenylcarbamamido)-1,3-benzothiazol-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | D451-0763 |
| Compound Name: | N-(2-methylphenyl)-2-{[6-(phenylcarbamamido)-1,3-benzothiazol-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 448.56 |
| Molecular Formula: | C23 H20 N4 O2 S2 |
| Smiles: | Cc1ccccc1NC(CSc1nc2ccc(cc2s1)NC(Nc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3933 |
| logD: | 5.3933 |
| logSw: | -5.3298 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 63.803 |
| InChI Key: | PTBKJKBTJZBJCS-UHFFFAOYSA-N |