N-[4-(methylsulfanyl)phenyl]-9-oxo-2-phenyl-1,5,6,9-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-7(8H)-carboxamide
Chemical Structure Depiction of
N-[4-(methylsulfanyl)phenyl]-9-oxo-2-phenyl-1,5,6,9-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-7(8H)-carboxamide
N-[4-(methylsulfanyl)phenyl]-9-oxo-2-phenyl-1,5,6,9-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-7(8H)-carboxamide
Compound characteristics
| Compound ID: | S022-1148 |
| Compound Name: | N-[4-(methylsulfanyl)phenyl]-9-oxo-2-phenyl-1,5,6,9-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-7(8H)-carboxamide |
| Molecular Weight: | 431.52 |
| Molecular Formula: | C23 H21 N5 O2 S |
| Smiles: | CSc1ccc(cc1)NC(N1CCC2=C(C1)C(N1C(C=C(c3ccccc3)N1)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1778 |
| logD: | 3.1776 |
| logSw: | -3.4921 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.615 |
| InChI Key: | WUDLEIRHYUQGAR-UHFFFAOYSA-N |