2,6-dimethyl-7-[2-(piperidine-1-carbonyl)pyrrolidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
2,6-dimethyl-7-[2-(piperidine-1-carbonyl)pyrrolidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
2,6-dimethyl-7-[2-(piperidine-1-carbonyl)pyrrolidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F632-0605 |
| Compound Name: | 2,6-dimethyl-7-[2-(piperidine-1-carbonyl)pyrrolidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 421.51 |
| Molecular Formula: | C20 H27 N3 O5 S |
| Smiles: | CC1C(Nc2cc(C)c(cc2O1)S(N1CCCC1C(N1CCCCC1)=O)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.5807 |
| logD: | 1.58 |
| logSw: | -2.4532 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.043 |
| InChI Key: | ZYTSFOWKECNHPW-UHFFFAOYSA-N |