5-[(4-fluorophenyl)methyl]-4-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
5-[(4-fluorophenyl)methyl]-4-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
5-[(4-fluorophenyl)methyl]-4-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | G542-0933 |
| Compound Name: | 5-[(4-fluorophenyl)methyl]-4-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 482.51 |
| Molecular Formula: | C25 H27 F N4 O5 |
| Smiles: | COc1cc(CNC(c2cc3C(N(CCCn3n2)Cc2ccc(cc2)F)=O)=O)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.3034 |
| logD: | 2.3034 |
| logSw: | -3.023 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.773 |
| InChI Key: | UWDFKEGHWCQECN-UHFFFAOYSA-N |