ethyl 4-{5-[(2-chloro-6-fluorophenyl)methyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carbonyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{5-[(2-chloro-6-fluorophenyl)methyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carbonyl}piperazine-1-carboxylate
ethyl 4-{5-[(2-chloro-6-fluorophenyl)methyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carbonyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | V018-8056 |
| Compound Name: | ethyl 4-{5-[(2-chloro-6-fluorophenyl)methyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carbonyl}piperazine-1-carboxylate |
| Molecular Weight: | 463.89 |
| Molecular Formula: | C21 H23 Cl F N5 O4 |
| Salt: | not_available |
| Smiles: | CCOC(N1CCN(CC1)C(c1cc2C(N(CCn2n1)Cc1c(cccc1[Cl])F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0107 |
| logD: | 2.0107 |
| logSw: | -2.8303 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.479 |
| InChI Key: | IHMBTTWRSVYCCW-UHFFFAOYSA-N |