7-[4-(1,3-benzothiazol-2-yl)butanoyl]-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one
Chemical Structure Depiction of
7-[4-(1,3-benzothiazol-2-yl)butanoyl]-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one
7-[4-(1,3-benzothiazol-2-yl)butanoyl]-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one
Compound characteristics
| Compound ID: | S022-1732 |
| Compound Name: | 7-[4-(1,3-benzothiazol-2-yl)butanoyl]-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C26 H23 N5 O2 S |
| Smiles: | C(CC(N1CCC2=C(C1)C(N1C(C=C(c3ccccc3)N1)=N2)=O)=O)Cc1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.3843 |
| logD: | 3.3841 |
| logSw: | -3.6878 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.482 |
| InChI Key: | XAAFXMSBKLMPMT-UHFFFAOYSA-N |