methyl [2-methyl-5-(N''-nitrocarbamimidamido)phenyl]carbamate
Chemical Structure Depiction of
methyl [2-methyl-5-(N''-nitrocarbamimidamido)phenyl]carbamate
methyl [2-methyl-5-(N''-nitrocarbamimidamido)phenyl]carbamate
Compound characteristics
| Compound ID: | 4877-0105 |
| Compound Name: | methyl [2-methyl-5-(N''-nitrocarbamimidamido)phenyl]carbamate |
| Molecular Weight: | 267.24 |
| Molecular Formula: | C10 H13 N5 O4 |
| Smiles: | Cc1ccc(cc1NC(=O)OC)NC(/N)=N/[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.5045 |
| logD: | 0.2591 |
| logSw: | -2.0035 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 107.54 |
| InChI Key: | FRBFCFZDGQKQAG-UHFFFAOYSA-N |