5-[(4-fluorophenyl)methyl]-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-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-[(propan-2-yl)oxy]propyl}-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
5-[(4-fluorophenyl)methyl]-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | G542-0858 |
| Compound Name: | 5-[(4-fluorophenyl)methyl]-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 402.47 |
| Molecular Formula: | C21 H27 F N4 O3 |
| Smiles: | CC(C)OCCCNC(c1cc2C(N(CCCn2n1)Cc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6881 |
| logD: | 1.6881 |
| logSw: | -2.3756 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.109 |
| InChI Key: | BIDGWRXGHJTWKM-UHFFFAOYSA-N |