4-(3,4-dichlorophenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene
Chemical Structure Depiction of
4-(3,4-dichlorophenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene
4-(3,4-dichlorophenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene
Compound characteristics
| Compound ID: | 8013-3293 |
| Compound Name: | 4-(3,4-dichlorophenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene |
| Molecular Weight: | 396.32 |
| Molecular Formula: | C22 H19 Cl2 N3 |
| Smiles: | Cc1ccc(cc1)C1=Nn2cc(c3ccc(c(c3)[Cl])[Cl])c3CCCCN1c23 |
| Stereo: | ACHIRAL |
| logP: | 7.2296 |
| logD: | 7.2296 |
| logSw: | -6.8908 |
| Hydrogen bond acceptors count: | 1 |
| Polar surface area: | 16.1443 |
| InChI Key: | JSVMLJZEBYAGPY-UHFFFAOYSA-N |