5-[(3-fluorophenyl)methyl]-4-oxo-N-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
5-[(3-fluorophenyl)methyl]-4-oxo-N-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
5-[(3-fluorophenyl)methyl]-4-oxo-N-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | G542-2147 |
| Compound Name: | 5-[(3-fluorophenyl)methyl]-4-oxo-N-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 468.48 |
| Molecular Formula: | C24 H25 F N4 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)NC(c1cc2C(N(CCCn2n1)Cc1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.252 |
| logD: | 2.2301 |
| logSw: | -3.0693 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.451 |
| InChI Key: | PNAGGTSIMJOCKS-UHFFFAOYSA-N |