N-methyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-9H-xanthene-9-carboxamide
Chemical Structure Depiction of
N-methyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-9H-xanthene-9-carboxamide
N-methyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-9H-xanthene-9-carboxamide
Compound characteristics
| Compound ID: | Y204-3890 |
| Compound Name: | N-methyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-9H-xanthene-9-carboxamide |
| Molecular Weight: | 361.44 |
| Molecular Formula: | C22 H23 N3 O2 |
| Smiles: | Cc1c(CN(C)C(C2c3ccccc3Oc3ccccc23)=O)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.6649 |
| logD: | -4.0053 |
| logSw: | -3.0281 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.042 |
| InChI Key: | QMMJBGXVWOAXFF-UHFFFAOYSA-N |