N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-methyl-3-phenylcinnoline-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-methyl-3-phenylcinnoline-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-methyl-3-phenylcinnoline-4-carboxamide
Compound characteristics
| Compound ID: | F146-2038 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-methyl-3-phenylcinnoline-4-carboxamide |
| Molecular Weight: | 397.43 |
| Molecular Formula: | C24 H19 N3 O3 |
| Smiles: | Cc1ccc2c(c1)c(C(NCc1ccc3c(c1)OCO3)=O)c(c1ccccc1)nn2 |
| Stereo: | ACHIRAL |
| logP: | 4.0261 |
| logD: | 4.0261 |
| logSw: | -4.1942 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.724 |
| InChI Key: | RJOFFFNCHHCBRD-UHFFFAOYSA-N |