7-[2-(azepane-1-carbonyl)pyrrolidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-[2-(azepane-1-carbonyl)pyrrolidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one
7-[2-(azepane-1-carbonyl)pyrrolidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | G851-1102 |
| Compound Name: | 7-[2-(azepane-1-carbonyl)pyrrolidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 421.51 |
| Molecular Formula: | C20 H27 N3 O5 S |
| Smiles: | Cc1cc2c(cc1S(N1CCCC1C(N1CCCCCC1)=O)(=O)=O)OCC(N2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4905 |
| logD: | 1.4899 |
| logSw: | -2.4067 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.036 |
| InChI Key: | OVWAVLPDBXZWMU-INIZCTEOSA-N |