N-(4-bromophenyl)-4-(thiophen-2-yl)-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-bromophenyl)-4-(thiophen-2-yl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
N-(4-bromophenyl)-4-(thiophen-2-yl)-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: | G281-1365 |
Compound Name: | N-(4-bromophenyl)-4-(thiophen-2-yl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
Molecular Weight: | 524.5 |
Molecular Formula: | C25 H22 Br N3 O S2 |
Smiles: | C1CCc2c(C1)c1CN(C(c3cccn3c1s2)c1cccs1)C(Nc1ccc(cc1)[Br])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 7.3218 |
logD: | 7.3218 |
logSw: | -5.9609 |
Hydrogen bond acceptors count: | 2 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 27.9616 |
InChI Key: | DYXYMAWZSPBORT-QHCPKHFHSA-N |