6-{2-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]pyrrolidine-1-sulfonyl}-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-{2-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]pyrrolidine-1-sulfonyl}-2H-1,4-benzoxazin-3(4H)-one
6-{2-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]pyrrolidine-1-sulfonyl}-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F822-0082 |
| Compound Name: | 6-{2-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]pyrrolidine-1-sulfonyl}-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 498.6 |
| Molecular Formula: | C25 H30 N4 O5 S |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C(C1CCCN1S(c1ccc2c(c1)NC(CO2)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5363 |
| logD: | 2.536 |
| logSw: | -2.9475 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.664 |
| InChI Key: | OFPVWOUEZZJFJA-QFIPXVFZSA-N |