S-{2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl} benzenecarbothioate
Chemical Structure Depiction of
S-{2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl} benzenecarbothioate
S-{2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl} benzenecarbothioate
Compound characteristics
| Compound ID: | 8006-2677 |
| Compound Name: | S-{2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl} benzenecarbothioate |
| Molecular Weight: | 306.77 |
| Molecular Formula: | C14 H11 Cl N2 O2 S |
| Smiles: | C(C(Nc1ccc(cn1)[Cl])=O)SC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6643 |
| logD: | 3.6586 |
| logSw: | -4.0537 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.093 |
| InChI Key: | GPPJXGRVQBXUBQ-UHFFFAOYSA-N |