1-[2-(3,4-dimethoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-(4-ethoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-[2-(3,4-dimethoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-(4-ethoxyphenyl)ethan-1-one
1-[2-(3,4-dimethoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-(4-ethoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | T200-0004 |
| Compound Name: | 1-[2-(3,4-dimethoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-(4-ethoxyphenyl)ethan-1-one |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C25 H29 N3 O4 |
| Smiles: | CCOc1ccc(CC(N2CCCn3c(C2)cc(c2ccc(c(c2)OC)OC)n3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4842 |
| logD: | 3.4842 |
| logSw: | -3.496 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.274 |
| InChI Key: | OTPJLHAHWOSKQU-UHFFFAOYSA-N |