1-[2-(3,4-dimethoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-(thiophen-3-yl)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-(thiophen-3-yl)ethan-1-one
1-[2-(3,4-dimethoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-(thiophen-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | T200-0069 |
| Compound Name: | 1-[2-(3,4-dimethoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-(thiophen-3-yl)ethan-1-one |
| Molecular Weight: | 397.49 |
| Molecular Formula: | C21 H23 N3 O3 S |
| Smiles: | COc1ccc(cc1OC)c1cc2CN(CCCn2n1)C(Cc1ccsc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8667 |
| logD: | 2.8667 |
| logSw: | -3.1893 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.169 |
| InChI Key: | OPPJKSOGHLXHCH-UHFFFAOYSA-N |