N-benzyltriimidodicarbonic diamide--4-methylbenzene-1-sulfonic acid (1/1)
Chemical Structure Depiction of
N-benzyltriimidodicarbonic diamide--4-methylbenzene-1-sulfonic acid (1/1)
N-benzyltriimidodicarbonic diamide--4-methylbenzene-1-sulfonic acid (1/1)
Compound characteristics
| Compound ID: | 0359-0110 |
| Compound Name: | N-benzyltriimidodicarbonic diamide--4-methylbenzene-1-sulfonic acid (1/1) |
| Molecular Weight: | 363.44 |
| Molecular Formula: | C9 H13 N5 |
| Salt: | p-CH3C6H4SO3H |
| Smiles: | C(c1ccccc1)NC(=N)NC(N)=N |
| Stereo: | ACHIRAL |
| logP: | -0.5169 |
| logD: | -2.542 |
| logSw: | -0.942 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 6 |
| Polar surface area: | 78.09 |
| InChI Key: | IBWXAMPUVRBFIS-UHFFFAOYSA-N |