2-(nitroimino)-1,3-diazinan-5-yl phenylcarbamate
Chemical Structure Depiction of
2-(nitroimino)-1,3-diazinan-5-yl phenylcarbamate
2-(nitroimino)-1,3-diazinan-5-yl phenylcarbamate
Compound characteristics
| Compound ID: | 4877-0061 |
| Compound Name: | 2-(nitroimino)-1,3-diazinan-5-yl phenylcarbamate |
| Molecular Weight: | 279.25 |
| Molecular Formula: | C11 H13 N5 O4 |
| Smiles: | C1C(CNC(N1)=N[N+]([O-])=O)OC(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7434 |
| logD: | 0.3486 |
| logSw: | -1.82 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.485 |
| InChI Key: | LJTJEYSFEAWLLQ-UHFFFAOYSA-N |