6-{2-[4-(2-fluorophenyl)piperazine-1-carbonyl]pyrrolidine-1-sulfonyl}-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-{2-[4-(2-fluorophenyl)piperazine-1-carbonyl]pyrrolidine-1-sulfonyl}-2H-1,4-benzoxazin-3(4H)-one
6-{2-[4-(2-fluorophenyl)piperazine-1-carbonyl]pyrrolidine-1-sulfonyl}-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F822-0177 |
| Compound Name: | 6-{2-[4-(2-fluorophenyl)piperazine-1-carbonyl]pyrrolidine-1-sulfonyl}-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 488.54 |
| Molecular Formula: | C23 H25 F N4 O5 S |
| Smiles: | C1CC(C(N2CCN(CC2)c2ccccc2F)=O)N(C1)S(c1ccc2c(c1)NC(CO2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5912 |
| logD: | 1.591 |
| logSw: | -2.7115 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.664 |
| InChI Key: | RQSMPXYYVONTRJ-FQEVSTJZSA-N |