ethyl N-[4-(3,5-difluorophenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]glycinate
Chemical Structure Depiction of
ethyl N-[4-(3,5-difluorophenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]glycinate
ethyl N-[4-(3,5-difluorophenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]glycinate
Compound characteristics
| Compound ID: | G281-0899 |
| Compound Name: | ethyl N-[4-(3,5-difluorophenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]glycinate |
| Molecular Weight: | 485.55 |
| Molecular Formula: | C25 H25 F2 N3 O3 S |
| Smiles: | CCOC(CNC(N1Cc2c3CCCCc3sc2n2cccc2C1c1cc(cc(c1)F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6732 |
| logD: | 5.6732 |
| logSw: | -5.2815 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.696 |
| InChI Key: | MMGYMCKKMISCNA-QHCPKHFHSA-N |