N-(3-chlorophenyl)-1-(phenoxymethyl)-4-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-1-(phenoxymethyl)-4-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide
N-(3-chlorophenyl)-1-(phenoxymethyl)-4-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide
Compound characteristics
| Compound ID: | 8013-6978 |
| Compound Name: | N-(3-chlorophenyl)-1-(phenoxymethyl)-4-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide |
| Molecular Weight: | 497 |
| Molecular Formula: | C29 H25 Cl N4 O2 |
| Smiles: | C1CCN2C(COc3ccccc3)=Nn3c(C(Nc4cccc(c4)[Cl])=O)c(c4ccccc4)c(C1)c23 |
| Stereo: | ACHIRAL |
| logP: | 7.2393 |
| logD: | 7.2393 |
| logSw: | -6.6215 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.03 |
| InChI Key: | PHHODPLBJHJIPG-UHFFFAOYSA-N |