trimethyl N-(3-methoxy-6-nitro-1,2-benzothiazol-4-yl)phosphorimidate
Chemical Structure Depiction of
trimethyl N-(3-methoxy-6-nitro-1,2-benzothiazol-4-yl)phosphorimidate
trimethyl N-(3-methoxy-6-nitro-1,2-benzothiazol-4-yl)phosphorimidate
Compound characteristics
| Compound ID: | 8010-5079 |
| Compound Name: | trimethyl N-(3-methoxy-6-nitro-1,2-benzothiazol-4-yl)phosphorimidate |
| Molecular Weight: | 347.28 |
| Molecular Formula: | C11 H14 N3 O6 P S |
| Smiles: | COc1c2c(cc(cc2sn1)[N+]([O-])=O)N=P(OC)(OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.2849 |
| logD: | 2.2849 |
| logSw: | -2.3381 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.849 |
| InChI Key: | UBMDPJFUXSGEKJ-UHFFFAOYSA-N |