2,6-dimethyl-7-[2-(4-phenylpiperazine-1-carbonyl)pyrrolidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
2,6-dimethyl-7-[2-(4-phenylpiperazine-1-carbonyl)pyrrolidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
2,6-dimethyl-7-[2-(4-phenylpiperazine-1-carbonyl)pyrrolidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F632-0466 |
| Compound Name: | 2,6-dimethyl-7-[2-(4-phenylpiperazine-1-carbonyl)pyrrolidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 498.6 |
| Molecular Formula: | C25 H30 N4 O5 S |
| Smiles: | CC1C(Nc2cc(C)c(cc2O1)S(N1CCCC1C(N1CCN(CC1)c1ccccc1)=O)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.2159 |
| logD: | 2.2152 |
| logSw: | -2.8929 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.303 |
| InChI Key: | SETXBFCNFVNUFN-UHFFFAOYSA-N |