3-(1,3-benzothiazol-2-yl)-1-[3-(1-cyclopentyl-1H-tetrazol-5-yl)-3-(dimethylamino)pyrrolidin-1-yl]propan-1-one
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-1-[3-(1-cyclopentyl-1H-tetrazol-5-yl)-3-(dimethylamino)pyrrolidin-1-yl]propan-1-one
3-(1,3-benzothiazol-2-yl)-1-[3-(1-cyclopentyl-1H-tetrazol-5-yl)-3-(dimethylamino)pyrrolidin-1-yl]propan-1-one
Compound characteristics
| Compound ID: | SA21-1336 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-1-[3-(1-cyclopentyl-1H-tetrazol-5-yl)-3-(dimethylamino)pyrrolidin-1-yl]propan-1-one |
| Molecular Weight: | 439.58 |
| Molecular Formula: | C22 H29 N7 O S |
| Smiles: | CN(C)C1(CCN(C1)C(CCc1nc2ccccc2s1)=O)c1nnnn1C1CCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0501 |
| logD: | 3.0282 |
| logSw: | -3.1496 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.571 |
| InChI Key: | KWBRGCRGBYXCEC-QFIPXVFZSA-N |