9-ethyl-N-(3-methylbutyl)-4-(4-methylphenyl)-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
9-ethyl-N-(3-methylbutyl)-4-(4-methylphenyl)-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
9-ethyl-N-(3-methylbutyl)-4-(4-methylphenyl)-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: | G281-2924 |
| Compound Name: | 9-ethyl-N-(3-methylbutyl)-4-(4-methylphenyl)-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: | 476.68 |
| Molecular Formula: | C28 H36 N4 O S |
| Smiles: | CCN1CCc2c3CN(C(c4ccc(C)cc4)c4cccn4c3sc2C1)C(NCCC(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7915 |
| logD: | 4.876 |
| logSw: | -5.5611 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.849 |
| InChI Key: | SZHKVZUBLYQMNC-SANMLTNESA-N |