methyl N-(2-nitrobenzoyl)carbamimidothioate
Chemical Structure Depiction of
methyl N-(2-nitrobenzoyl)carbamimidothioate
methyl N-(2-nitrobenzoyl)carbamimidothioate
Compound characteristics
| Compound ID: | 8010-5833 |
| Compound Name: | methyl N-(2-nitrobenzoyl)carbamimidothioate |
| Molecular Weight: | 239.25 |
| Molecular Formula: | C9 H9 N3 O3 S |
| Smiles: | CSC(=N)NC(c1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1191 |
| logD: | -0.6822 |
| logSw: | -2.4003 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.961 |
| InChI Key: | CEUNETKZMDXPEW-UHFFFAOYSA-N |