N-({4-[(6-chloropyridin-3-yl)methoxy]-3-methoxyphenyl}methyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-({4-[(6-chloropyridin-3-yl)methoxy]-3-methoxyphenyl}methyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
N-({4-[(6-chloropyridin-3-yl)methoxy]-3-methoxyphenyl}methyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | D175-0061 |
Compound Name: | N-({4-[(6-chloropyridin-3-yl)methoxy]-3-methoxyphenyl}methyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1) |
Molecular Weight: | 457.38 |
Molecular Formula: | C18 H21 Cl N6 O2 S |
Salt: | HCl |
Smiles: | [H]N(CCSc1nnnn1C)Cc1ccc(c(c1)OC)OCc1ccc(nc1)[Cl] |
Stereo: | ACHIRAL |
logP: | 1.3277 |
logD: | -2.9683 |
logSw: | -2.5507 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.138 |
InChI Key: | ICSTWBSKDRWZOF-UHFFFAOYSA-N |