(azepan-1-yl){5-[(2-methylbenzene-1-sulfinyl)methyl]furan-2-yl}methanone
Chemical Structure Depiction of
(azepan-1-yl){5-[(2-methylbenzene-1-sulfinyl)methyl]furan-2-yl}methanone
(azepan-1-yl){5-[(2-methylbenzene-1-sulfinyl)methyl]furan-2-yl}methanone
Compound characteristics
| Compound ID: | C520-0850 |
| Compound Name: | (azepan-1-yl){5-[(2-methylbenzene-1-sulfinyl)methyl]furan-2-yl}methanone |
| Molecular Weight: | 345.46 |
| Molecular Formula: | C19 H23 N O3 S |
| Smiles: | Cc1ccccc1S(Cc1ccc(C(N2CCCCCC2)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6083 |
| logD: | 3.6083 |
| logSw: | -3.5668 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.2 |
| InChI Key: | KXLZZLXMQICNEX-UHFFFAOYSA-N |