N-[(5-bromo-2-methoxyphenyl)methyl]-5-[(4-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-5-[(4-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-5-[(4-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | G542-0620 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-5-[(4-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 497.39 |
| Molecular Formula: | C24 H25 Br N4 O3 |
| Smiles: | Cc1ccc(CN2CCCn3c(cc(C(NCc4cc(ccc4OC)[Br])=O)n3)C2=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8095 |
| logD: | 3.8094 |
| logSw: | -3.8597 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.425 |
| InChI Key: | GZFUWNDINQLKDW-UHFFFAOYSA-N |