N-ethyl-5-[(4-fluorophenyl)methyl]-N-{3-[(2-methylpropyl)amino]-3-oxopropyl}-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
N-ethyl-5-[(4-fluorophenyl)methyl]-N-{3-[(2-methylpropyl)amino]-3-oxopropyl}-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
N-ethyl-5-[(4-fluorophenyl)methyl]-N-{3-[(2-methylpropyl)amino]-3-oxopropyl}-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | V018-2771 |
| Compound Name: | N-ethyl-5-[(4-fluorophenyl)methyl]-N-{3-[(2-methylpropyl)amino]-3-oxopropyl}-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C24 H32 F N5 O3 |
| Salt: | not_available |
| Smiles: | CCN(CCC(NCC(C)C)=O)C(c1cc2C(N(CCCn2n1)Cc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.81 |
| logD: | 1.81 |
| logSw: | -2.505 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.039 |
| InChI Key: | MZWYQXQGUIIOPW-UHFFFAOYSA-N |