7-[3-(1,3-benzothiazol-2-yl)propanoyl]-2-[(4-methoxyphenyl)methyl]-2,7-diazaspiro[3.5]nonan-1-one
Chemical Structure Depiction of
7-[3-(1,3-benzothiazol-2-yl)propanoyl]-2-[(4-methoxyphenyl)methyl]-2,7-diazaspiro[3.5]nonan-1-one
7-[3-(1,3-benzothiazol-2-yl)propanoyl]-2-[(4-methoxyphenyl)methyl]-2,7-diazaspiro[3.5]nonan-1-one
Compound characteristics
| Compound ID: | S610-0957 |
| Compound Name: | 7-[3-(1,3-benzothiazol-2-yl)propanoyl]-2-[(4-methoxyphenyl)methyl]-2,7-diazaspiro[3.5]nonan-1-one |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C25 H27 N3 O3 S |
| Smiles: | COc1ccc(CN2CC3(CCN(CC3)C(CCc3nc4ccccc4s3)=O)C2=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2569 |
| logD: | 3.2569 |
| logSw: | -3.3358 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.73 |
| InChI Key: | BDUMRRBTOISXFK-UHFFFAOYSA-N |