N-(2-{[2-(adamantan-1-yl)ethyl]carbamoyl}phenyl)-1,2-benzothiazole-3-carboxamide
Chemical Structure Depiction of
N-(2-{[2-(adamantan-1-yl)ethyl]carbamoyl}phenyl)-1,2-benzothiazole-3-carboxamide
N-(2-{[2-(adamantan-1-yl)ethyl]carbamoyl}phenyl)-1,2-benzothiazole-3-carboxamide
Compound characteristics
| Compound ID: | G795-0586 |
| Compound Name: | N-(2-{[2-(adamantan-1-yl)ethyl]carbamoyl}phenyl)-1,2-benzothiazole-3-carboxamide |
| Molecular Weight: | 459.61 |
| Molecular Formula: | C27 H29 N3 O2 S |
| Smiles: | C1C2CC3CC1CC(CCNC(c1ccccc1NC(c1c4ccccc4sn1)=O)=O)(C2)C3 |
| Stereo: | ACHIRAL |
| logP: | 6.0893 |
| logD: | 6.0892 |
| logSw: | -6.1797 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.91 |
| InChI Key: | NAJOAFWPRVNUCJ-UHFFFAOYSA-N |