2-(4-chlorophenoxy)-1-[2-(3-methylphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-chlorophenoxy)-1-[2-(3-methylphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]ethan-1-one
2-(4-chlorophenoxy)-1-[2-(3-methylphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | P218-0481 |
| Compound Name: | 2-(4-chlorophenoxy)-1-[2-(3-methylphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]ethan-1-one |
| Molecular Weight: | 395.89 |
| Molecular Formula: | C22 H22 Cl N3 O2 |
| Smiles: | Cc1cccc(c1)c1cc2CN(CCCn2n1)C(COc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9587 |
| logD: | 3.9587 |
| logSw: | -4.2341 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.389 |
| InChI Key: | BBCXOZFQPUAJRH-UHFFFAOYSA-N |