3-(1,3-benzothiazol-2-yl)-N-{[1-(cyclopropylmethyl)-2-oxo-1,2,3,4,5,6-hexahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}propanamide
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-N-{[1-(cyclopropylmethyl)-2-oxo-1,2,3,4,5,6-hexahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}propanamide
3-(1,3-benzothiazol-2-yl)-N-{[1-(cyclopropylmethyl)-2-oxo-1,2,3,4,5,6-hexahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}propanamide
Compound characteristics
| Compound ID: | S571-0361 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-N-{[1-(cyclopropylmethyl)-2-oxo-1,2,3,4,5,6-hexahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}propanamide |
| Molecular Weight: | 409.55 |
| Molecular Formula: | C23 H27 N3 O2 S |
| Smiles: | C1CC2(CCC(N(CC3CC3)C2=C1)=O)CNC(CCc1nc2ccccc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1508 |
| logD: | 4.1508 |
| logSw: | -4.2918 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.935 |
| InChI Key: | XYFSQHMBUIONAV-QHCPKHFHSA-N |