N-[2-(dimethylamino)ethyl]-5-[(3-fluorophenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
N-[2-(dimethylamino)ethyl]-5-[(3-fluorophenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
N-[2-(dimethylamino)ethyl]-5-[(3-fluorophenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | G542-2130 |
| Compound Name: | N-[2-(dimethylamino)ethyl]-5-[(3-fluorophenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 373.43 |
| Molecular Formula: | C19 H24 F N5 O2 |
| Smiles: | CN(C)CCNC(c1cc2C(N(CCCn2n1)Cc1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9507 |
| logD: | -0.1906 |
| logSw: | -2.0345 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.774 |
| InChI Key: | GEKKWRLBCBSLJQ-UHFFFAOYSA-N |