N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-methylaniline--oxalic acid (1/1)
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-methylaniline--oxalic acid (1/1)
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-methylaniline--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3169-0108 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-methylaniline--oxalic acid (1/1) |
| Molecular Weight: | 331.32 |
| Molecular Formula: | C15 H15 N O2 |
| Salt: | HOOCCOOH |
| Smiles: | Cc1cccc(c1)NCc1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.4447 |
| logD: | 3.4447 |
| logSw: | -3.4412 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.5884 |
| InChI Key: | OUYZQYDFMRHZNN-UHFFFAOYSA-N |