methyl 4-[(4-ethyl-9-oxo-4,5,6,7,8,9-hexahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-3-carbonyl)amino]benzoate--hydrogen chloride (1/1)
Chemical Structure Depiction of
methyl 4-[(4-ethyl-9-oxo-4,5,6,7,8,9-hexahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-3-carbonyl)amino]benzoate--hydrogen chloride (1/1)
methyl 4-[(4-ethyl-9-oxo-4,5,6,7,8,9-hexahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-3-carbonyl)amino]benzoate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | G657-0439 |
| Compound Name: | methyl 4-[(4-ethyl-9-oxo-4,5,6,7,8,9-hexahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-3-carbonyl)amino]benzoate--hydrogen chloride (1/1) |
| Molecular Weight: | 431.88 |
| Molecular Formula: | C20 H21 N5 O4 |
| Salt: | HCl |
| Smiles: | CCN1C2CCNCC=2C(n2c1c(cn2)C(Nc1ccc(cc1)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.562 |
| logD: | 1.2192 |
| logSw: | -2.3363 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.825 |
| InChI Key: | BXBGGOJCDHHCDK-UHFFFAOYSA-N |