sodium--S-(3-{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}-3-oxopropyl) sulfurothioate (1/1)
Chemical Structure Depiction of
sodium--S-(3-{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}-3-oxopropyl) sulfurothioate (1/1)
sodium--S-(3-{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}-3-oxopropyl) sulfurothioate (1/1)
Compound characteristics
| Compound ID: | 4513-0413 |
| Compound Name: | sodium--S-(3-{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}-3-oxopropyl) sulfurothioate (1/1) |
| Molecular Weight: | 380.41 |
| Molecular Formula: | C14 H17 N2 O5 S2 |
| Salt: | Na+ |
| Smiles: | COc1ccc2c(c1)c(CCNC(CCSS([O-])(=O)=O)=O)c[nH]2 |
| Stereo: | ACHIRAL |
| logP: | -0.3133 |
| logD: | -0.3133 |
| logSw: | -2.0263 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.925 |
| InChI Key: | PTXXDIOVHKOXFS-UHFFFAOYSA-M |