dimethyl N-(3-chloro-6-nitro-1,2-benzothiazol-4-yl)phosphoramidate
Chemical Structure Depiction of
dimethyl N-(3-chloro-6-nitro-1,2-benzothiazol-4-yl)phosphoramidate
dimethyl N-(3-chloro-6-nitro-1,2-benzothiazol-4-yl)phosphoramidate
Compound characteristics
| Compound ID: | 8010-5843 |
| Compound Name: | dimethyl N-(3-chloro-6-nitro-1,2-benzothiazol-4-yl)phosphoramidate |
| Molecular Weight: | 337.67 |
| Molecular Formula: | C9 H9 Cl N3 O5 P S |
| Smiles: | COP(Nc1cc(cc2c1c(ns2)[Cl])[N+]([O-])=O)(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.9462 |
| logD: | 1.9462 |
| logSw: | -2.7917 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.52 |
| InChI Key: | DVVOJALJMKYIJW-UHFFFAOYSA-N |