7-[3-(azepane-1-carbonyl)piperidine-1-sulfonyl]-2-ethyl-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-[3-(azepane-1-carbonyl)piperidine-1-sulfonyl]-2-ethyl-6-methyl-2H-1,4-benzoxazin-3(4H)-one
7-[3-(azepane-1-carbonyl)piperidine-1-sulfonyl]-2-ethyl-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F184-3442 |
| Compound Name: | 7-[3-(azepane-1-carbonyl)piperidine-1-sulfonyl]-2-ethyl-6-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 463.6 |
| Molecular Formula: | C23 H33 N3 O5 S |
| Smiles: | CCC1C(Nc2cc(C)c(cc2O1)S(N1CCCC(C1)C(N1CCCCCC1)=O)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9182 |
| logD: | 2.9172 |
| logSw: | -3.2558 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.665 |
| InChI Key: | RAEZIWLMSGNAJH-UHFFFAOYSA-N |