4-(3,4-dimethylphenyl)-N-(4-methoxyphenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Chemical Structure Depiction of
4-(3,4-dimethylphenyl)-N-(4-methoxyphenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
4-(3,4-dimethylphenyl)-N-(4-methoxyphenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Compound characteristics
| Compound ID: | 8017-4190 |
| Compound Name: | 4-(3,4-dimethylphenyl)-N-(4-methoxyphenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide |
| Molecular Weight: | 503.64 |
| Molecular Formula: | C33 H33 N3 O2 |
| Smiles: | Cc1ccc(cc1)c1c2CCCCN3C(=Cn(c1C(Nc1ccc(cc1)OC)=O)c23)c1ccc(C)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 8.101 |
| logD: | 8.101 |
| logSw: | -5.6494 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.283 |
| InChI Key: | QSJYTUJSRHULRD-UHFFFAOYSA-N |