{4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(1-methyl-1H-indazol-3-yl)methanone
Chemical Structure Depiction of
{4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(1-methyl-1H-indazol-3-yl)methanone
{4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(1-methyl-1H-indazol-3-yl)methanone
Compound characteristics
| Compound ID: | P803-1082 |
| Compound Name: | {4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(1-methyl-1H-indazol-3-yl)methanone |
| Molecular Weight: | 434.93 |
| Molecular Formula: | C23 H23 Cl N6 O |
| Smiles: | Cn1c2ccccc2c(C(N2CCCN(CC2)c2cc(c3ccc(cc3)[Cl])n[nH]2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.9787 |
| logD: | 3.9787 |
| logSw: | -4.3839 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.967 |
| InChI Key: | BPUKAEJDRNTSIF-UHFFFAOYSA-N |