4-(4-chlorophenyl)-N,1-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
					Chemical Structure Depiction of
4-(4-chlorophenyl)-N,1-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
			4-(4-chlorophenyl)-N,1-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Compound characteristics
| Compound ID: | 8013-6954 | 
| Compound Name: | 4-(4-chlorophenyl)-N,1-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide | 
| Molecular Weight: | 483.03 | 
| Molecular Formula: | C28 H23 Cl N4 S | 
| Smiles: | C1CCN2C(c3ccccc3)=Nn3c(C(Nc4ccccc4)=S)c(c4ccc(cc4)[Cl])c(C1)c23 | 
| Stereo: | ACHIRAL | 
| logP: | 7.8751 | 
| logD: | 7.8751 | 
| logSw: | -7.0029 | 
| Hydrogen bond acceptors count: | 3 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 24.0655 | 
| InChI Key: | DOEWZRLIVDJQEU-UHFFFAOYSA-N | 
 
				 
				