6-[4-(1,3-benzothiazol-2-yl)butanoyl]-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Chemical Structure Depiction of
6-[4-(1,3-benzothiazol-2-yl)butanoyl]-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
6-[4-(1,3-benzothiazol-2-yl)butanoyl]-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Compound characteristics
| Compound ID: | S021-2294 |
| Compound Name: | 6-[4-(1,3-benzothiazol-2-yl)butanoyl]-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C26 H23 N5 O2 S |
| Smiles: | C(CC(N1CCC2=C(C1)N=C1C=C(c3ccccc3)NN1C2=O)=O)Cc1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.4847 |
| logD: | 3.4846 |
| logSw: | -3.721 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.482 |
| InChI Key: | YAVWGANMQVWHPW-UHFFFAOYSA-N |