2-chloro-7-nitro-9H-thioxanthen-9-one
Chemical Structure Depiction of
2-chloro-7-nitro-9H-thioxanthen-9-one
2-chloro-7-nitro-9H-thioxanthen-9-one
Compound characteristics
Compound ID: | 8014-3047 |
Compound Name: | 2-chloro-7-nitro-9H-thioxanthen-9-one |
Molecular Weight: | 291.71 |
Molecular Formula: | C13 H6 Cl N O3 S |
Smiles: | c1cc2c(cc1[N+]([O-])=O)C(c1cc(ccc1S2)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 4.6567 |
logD: | 4.6567 |
logSw: | -5.0066 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 46.415 |
InChI Key: | SFZUTEKCOUBULG-UHFFFAOYSA-N |