4-(1,3-benzothiazol-2-yl)-N-[2-(1-propyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)ethyl]butanamide
Chemical Structure Depiction of
4-(1,3-benzothiazol-2-yl)-N-[2-(1-propyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)ethyl]butanamide
4-(1,3-benzothiazol-2-yl)-N-[2-(1-propyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)ethyl]butanamide
Compound characteristics
| Compound ID: | SA55-4225 |
| Compound Name: | 4-(1,3-benzothiazol-2-yl)-N-[2-(1-propyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)ethyl]butanamide |
| Molecular Weight: | 412.55 |
| Molecular Formula: | C22 H28 N4 O2 S |
| Smiles: | CCCn1c2CCOCc2c(CCNC(CCCc2nc3ccccc3s2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.4623 |
| logD: | 2.4623 |
| logSw: | -2.6574 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.028 |
| InChI Key: | QVDXHTRBPPDGDC-UHFFFAOYSA-N |