N-[2-(adamantan-1-yl)ethyl]-2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[2-(adamantan-1-yl)ethyl]-2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]acetamide
N-[2-(adamantan-1-yl)ethyl]-2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8012-7154 |
| Compound Name: | N-[2-(adamantan-1-yl)ethyl]-2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 421.02 |
| Molecular Formula: | C21 H25 Cl N2 O S2 |
| Smiles: | C1C2CC3CC1CC(CCNC(CSc1nc4cc(ccc4s1)[Cl])=O)(C2)C3 |
| Stereo: | ACHIRAL |
| logP: | 5.9909 |
| logD: | 5.9909 |
| logSw: | -6.3114 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.395 |
| InChI Key: | FCWQQVQPWWNCMY-UHFFFAOYSA-N |