4-(4-methoxyphenyl)-N,1-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide
Chemical Structure Depiction of
4-(4-methoxyphenyl)-N,1-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide
4-(4-methoxyphenyl)-N,1-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide
Compound characteristics
| Compound ID: | 8013-5186 |
| Compound Name: | 4-(4-methoxyphenyl)-N,1-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C29 H26 N4 O2 |
| Smiles: | COc1ccc(cc1)c1c2CCCCN3C(c4ccccc4)=Nn(c1C(Nc1ccccc1)=O)c23 |
| Stereo: | ACHIRAL |
| logP: | 6.6046 |
| logD: | 6.6046 |
| logSw: | -5.8422 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.219 |
| InChI Key: | ZKGUGXMPCWJYFA-UHFFFAOYSA-N |