4-(3-chlorophenyl)-N-(2,4-difluorophenyl)-9-methyl-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Chemical Structure Depiction of
4-(3-chlorophenyl)-N-(2,4-difluorophenyl)-9-methyl-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
4-(3-chlorophenyl)-N-(2,4-difluorophenyl)-9-methyl-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G281-2688 |
| Compound Name: | 4-(3-chlorophenyl)-N-(2,4-difluorophenyl)-9-methyl-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
| Molecular Weight: | 525.02 |
| Molecular Formula: | C27 H23 Cl F2 N4 O S |
| Smiles: | CN1CCc2c3CN(C(c4cccc(c4)[Cl])c4cccn4c3sc2C1)C(Nc1ccc(cc1F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4284 |
| logD: | 4.6646 |
| logSw: | -6.3243 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.6555 |
| InChI Key: | OJIFJZSHLIXDPV-RUZDIDTESA-N |