N-(2-methoxyphenyl)triimidodicarbonic diamide--4-methylbenzene-1-sulfonic acid (1/1)
Chemical Structure Depiction of
N-(2-methoxyphenyl)triimidodicarbonic diamide--4-methylbenzene-1-sulfonic acid (1/1)
N-(2-methoxyphenyl)triimidodicarbonic diamide--4-methylbenzene-1-sulfonic acid (1/1)
Compound characteristics
| Compound ID: | 0474-0080 |
| Compound Name: | N-(2-methoxyphenyl)triimidodicarbonic diamide--4-methylbenzene-1-sulfonic acid (1/1) |
| Molecular Weight: | 379.44 |
| Molecular Formula: | C9 H13 N5 O |
| Salt: | p-CH3C6H4SO3H |
| Smiles: | COc1ccccc1NC(=N)NC(N)=N |
| Stereo: | ACHIRAL |
| logP: | 0.3642 |
| logD: | -2.867 |
| logSw: | -1.526 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 6 |
| Polar surface area: | 83.7 |
| InChI Key: | QYLVXKQJMSWUHI-UHFFFAOYSA-N |