2-chloro-1,3-dioxo-2,3-dihydro-1H-inden-2-yl carbamimidothioate
Chemical Structure Depiction of
2-chloro-1,3-dioxo-2,3-dihydro-1H-inden-2-yl carbamimidothioate
2-chloro-1,3-dioxo-2,3-dihydro-1H-inden-2-yl carbamimidothioate
Compound characteristics
| Compound ID: | 8019-7864 |
| Compound Name: | 2-chloro-1,3-dioxo-2,3-dihydro-1H-inden-2-yl carbamimidothioate |
| Molecular Weight: | 254.69 |
| Molecular Formula: | C10 H7 Cl N2 O2 S |
| Smiles: | c1ccc2C(C(C(c2c1)=O)(SC(N)=N)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.6195 |
| logD: | -1 |
| logSw: | -2.7993 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.589 |
| InChI Key: | NITBCFXFULKWCZ-UHFFFAOYSA-N |