(1H-benzimidazol-5-yl){4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
(1H-benzimidazol-5-yl){4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone
(1H-benzimidazol-5-yl){4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone
Compound characteristics
| Compound ID: | P803-1103 |
| Compound Name: | (1H-benzimidazol-5-yl){4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 420.9 |
| Molecular Formula: | C22 H21 Cl N6 O |
| Smiles: | C1CN(CCN(C1)c1cc(c2ccc(cc2)[Cl])n[nH]1)C(c1ccc2c(c1)nc[nH]2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4137 |
| logD: | 3.4059 |
| logSw: | -3.8548 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.961 |
| InChI Key: | LUQNIRANLNYPQQ-UHFFFAOYSA-N |