2-amino-4-(4-methoxyphenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(4-methoxyphenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
2-amino-4-(4-methoxyphenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
Compound characteristics
Compound ID: | 3829-0622 |
Compound Name: | 2-amino-4-(4-methoxyphenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile |
Molecular Weight: | 307.39 |
Molecular Formula: | C19 H21 N3 O |
Smiles: | COc1ccc(cc1)c1c2CCCCCCc2nc(c1C#N)N |
Stereo: | ACHIRAL |
logP: | 4.4644 |
logD: | 4.4643 |
logSw: | -4.6563 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 55.632 |
InChI Key: | MVTANPWGMLPJFP-UHFFFAOYSA-N |