2-amino-4-(3,5-dichlorothiophen-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(3,5-dichlorothiophen-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
2-amino-4-(3,5-dichlorothiophen-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8004-9682 |
| Compound Name: | 2-amino-4-(3,5-dichlorothiophen-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile |
| Molecular Weight: | 352.28 |
| Molecular Formula: | C16 H15 Cl2 N3 S |
| Smiles: | C1CCCc2c(CC1)c(c(C#N)c(N)n2)c1c(cc(s1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.3692 |
| logD: | 5.3691 |
| logSw: | -6.452 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.106 |
| InChI Key: | UPFKOZHNLCPCKJ-UHFFFAOYSA-N |