4-(3,5-difluorophenyl)-N-(2,5-dimethoxyphenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Chemical Structure Depiction of
4-(3,5-difluorophenyl)-N-(2,5-dimethoxyphenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
4-(3,5-difluorophenyl)-N-(2,5-dimethoxyphenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G281-0848 |
| Compound Name: | 4-(3,5-difluorophenyl)-N-(2,5-dimethoxyphenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
| Molecular Weight: | 535.61 |
| Molecular Formula: | C29 H27 F2 N3 O3 S |
| Smiles: | COc1ccc(c(c1)NC(N1Cc2c3CCCCc3sc2n2cccc2C1c1cc(cc(c1)F)F)=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.1687 |
| logD: | 7.1687 |
| logSw: | -5.6589 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.42 |
| InChI Key: | PVBLXDMOIUQZCD-MHZLTWQESA-N |