N-(4-bromo-3-methylphenyl)-4-ethyl-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-(4-bromo-3-methylphenyl)-4-ethyl-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
N-(4-bromo-3-methylphenyl)-4-ethyl-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: | G281-1546 |
Compound Name: | N-(4-bromo-3-methylphenyl)-4-ethyl-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
Molecular Weight: | 484.46 |
Molecular Formula: | C24 H26 Br N3 O S |
Smiles: | CCC1c2cccn2c2c(CN1C(Nc1ccc(c(C)c1)[Br])=O)c1CCCCc1s2 |
Stereo: | RACEMIC MIXTURE |
logP: | 7.1895 |
logD: | 7.1895 |
logSw: | -5.5415 |
Hydrogen bond acceptors count: | 2 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 27.1671 |
InChI Key: | MCJVSQOQWVJBDF-FQEVSTJZSA-N |