2-(diethylamino)ethyl 4-[(1-methyl-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
2-(diethylamino)ethyl 4-[(1-methyl-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carbonyl)amino]benzoate
2-(diethylamino)ethyl 4-[(1-methyl-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | E146-1297 |
| Compound Name: | 2-(diethylamino)ethyl 4-[(1-methyl-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carbonyl)amino]benzoate |
| Molecular Weight: | 448.52 |
| Molecular Formula: | C25 H28 N4 O4 |
| Smiles: | CCN(CC)CCOC(c1ccc(cc1)NC(c1c2COc3ccccc3c2n(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8107 |
| logD: | 2.8423 |
| logSw: | -3.9506 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.561 |
| InChI Key: | DNBTYSQTPKVZSD-UHFFFAOYSA-N |