N-(3-chloro-4-fluorophenyl)-4-(4-methoxyphenyl)-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
N-(3-chloro-4-fluorophenyl)-4-(4-methoxyphenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
N-(3-chloro-4-fluorophenyl)-4-(4-methoxyphenyl)-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: | G281-0687 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-4-(4-methoxyphenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
| Molecular Weight: | 522.04 |
| Molecular Formula: | C28 H25 Cl F N3 O2 S |
| Smiles: | COc1ccc(cc1)C1c2cccn2c2c(CN1C(Nc1ccc(c(c1)[Cl])F)=O)c1CCCCc1s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.5762 |
| logD: | 7.5762 |
| logSw: | -6.53 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.487 |
| InChI Key: | VZVCKKLJIIMCBC-AREMUKBSSA-N |