N-[(3-bromophenyl)methyl]-5-[(3-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-5-[(3-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
N-[(3-bromophenyl)methyl]-5-[(3-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | G542-2619 |
| Compound Name: | N-[(3-bromophenyl)methyl]-5-[(3-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 467.36 |
| Molecular Formula: | C23 H23 Br N4 O2 |
| Smiles: | Cc1cccc(CN2CCCn3c(cc(C(NCc4cccc(c4)[Br])=O)n3)C2=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.8922 |
| logD: | 3.8922 |
| logSw: | -3.8504 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.795 |
| InChI Key: | JLCNJWNAXOABGR-UHFFFAOYSA-N |