11-[4-(1,3-benzothiazol-2-yl)butanoyl]-7-propyl-7,11,14-triazaspiro[5.10]hexadecan-15-one
Chemical Structure Depiction of
11-[4-(1,3-benzothiazol-2-yl)butanoyl]-7-propyl-7,11,14-triazaspiro[5.10]hexadecan-15-one
11-[4-(1,3-benzothiazol-2-yl)butanoyl]-7-propyl-7,11,14-triazaspiro[5.10]hexadecan-15-one
Compound characteristics
| Compound ID: | SB80-1303 |
| Compound Name: | 11-[4-(1,3-benzothiazol-2-yl)butanoyl]-7-propyl-7,11,14-triazaspiro[5.10]hexadecan-15-one |
| Molecular Weight: | 484.7 |
| Molecular Formula: | C27 H40 N4 O2 S |
| Smiles: | CCCN1CCCN(CCNC(CC12CCCCC2)=O)C(CCCc1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.972 |
| logD: | 2.3115 |
| logSw: | -3.8416 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.287 |
| InChI Key: | BTTAFVBFXRASLR-UHFFFAOYSA-N |