ethyl 2-amino-4-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
ethyl 2-amino-4-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate
ethyl 2-amino-4-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | Y509-0232 |
| Compound Name: | ethyl 2-amino-4-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 359.42 |
| Molecular Formula: | C19 H25 N3 O4 |
| Smiles: | CCn1c(C)c(C2C3=C(CCCC3=O)OC(=C2C(=O)OCC)N)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3241 |
| logD: | 1.3241 |
| logSw: | -1.3726 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.578 |
| InChI Key: | ZRINKRDVUCDWOW-MRXNPFEDSA-N |