N-(3-chlorophenyl)-4-(4-methoxyphenyl)-1-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-4-(4-methoxyphenyl)-1-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide
N-(3-chlorophenyl)-4-(4-methoxyphenyl)-1-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide
Compound characteristics
| Compound ID: | 8013-5187 |
| Compound Name: | N-(3-chlorophenyl)-4-(4-methoxyphenyl)-1-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: | COc1ccc(cc1)c1c2CCCCN3C(c4ccccc4)=Nn(c1C(Nc1cccc(c1)[Cl])=O)c23 |
| Stereo: | ACHIRAL |
| logP: | 7.5499 |
| logD: | 7.5497 |
| logSw: | -6.4121 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.219 |
| InChI Key: | XUDIGVGMUQCEEO-UHFFFAOYSA-N |