4-{[3-(azepane-1-carbonyl)-7-methyl-1,8-naphthyridin-4-yl]amino}benzonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-{[3-(azepane-1-carbonyl)-7-methyl-1,8-naphthyridin-4-yl]amino}benzonitrile--hydrogen chloride (1/1)
4-{[3-(azepane-1-carbonyl)-7-methyl-1,8-naphthyridin-4-yl]amino}benzonitrile--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | L968-0241 |
Compound Name: | 4-{[3-(azepane-1-carbonyl)-7-methyl-1,8-naphthyridin-4-yl]amino}benzonitrile--hydrogen chloride (1/1) |
Molecular Weight: | 421.93 |
Molecular Formula: | C23 H23 N5 O |
Salt: | HCl |
Smiles: | Cc1ccc2c(c(cnc2n1)C(N1CCCCCC1)=O)Nc1ccc(C#N)cc1 |
Stereo: | ACHIRAL |
logP: | 3.8342 |
logD: | 3.8334 |
logSw: | -3.8495 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.392 |
InChI Key: | QVAUSCZLSOTSPU-UHFFFAOYSA-N |