2-amino-4-(5-bromothiophen-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(5-bromothiophen-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
2-amino-4-(5-bromothiophen-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | Y508-0611 |
| Compound Name: | 2-amino-4-(5-bromothiophen-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile |
| Molecular Weight: | 362.29 |
| Molecular Formula: | C16 H16 Br N3 S |
| Smiles: | C1CCCc2c(CC1)c(c(C#N)c(N)n2)c1ccc(s1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.0358 |
| logD: | 5.0356 |
| logSw: | -4.8935 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.106 |
| InChI Key: | OOFCPPIWIUZURU-UHFFFAOYSA-N |