N-{2-[(adamantan-1-yl)oxy]ethyl}-1-methyl-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-{2-[(adamantan-1-yl)oxy]ethyl}-1-methyl-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carboxamide
N-{2-[(adamantan-1-yl)oxy]ethyl}-1-methyl-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | E146-1389 |
| Compound Name: | N-{2-[(adamantan-1-yl)oxy]ethyl}-1-methyl-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C24 H29 N3 O3 |
| Smiles: | Cn1c2c3ccccc3OCc2c(C(NCCOC23CC4CC(CC(C4)C3)C2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.9057 |
| logD: | 3.9057 |
| logSw: | -4.1958 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.526 |
| InChI Key: | QQLYMQXPJBFNOQ-UHFFFAOYSA-N |