4-(4-bromophenyl)-1-(4-chlorophenyl)-N-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Chemical Structure Depiction of
4-(4-bromophenyl)-1-(4-chlorophenyl)-N-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
4-(4-bromophenyl)-1-(4-chlorophenyl)-N-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Compound characteristics
Compound ID: | 8017-8922 |
Compound Name: | 4-(4-bromophenyl)-1-(4-chlorophenyl)-N-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide |
Molecular Weight: | 544.88 |
Molecular Formula: | C29 H23 Br Cl N3 O |
Smiles: | C1CCN2C(=Cn3c(C(Nc4ccccc4)=O)c(c4ccc(cc4)[Cl])c(C1)c23)c1ccc(cc1)[Br] |
Stereo: | ACHIRAL |
logP: | 7.9468 |
logD: | 7.9468 |
logSw: | -6.8523 |
Hydrogen bond acceptors count: | 2 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 25.7391 |
InChI Key: | WIDNLVDHWZFZMU-UHFFFAOYSA-N |